Ligand source activities (1 row/activity)
| Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Potency) |
# tested GPCRs (Potency) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
| 9868867 | 186529 | 0 | None | - | 1 | Mouse | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491667 | 186529 | 0 | None | - | 1 | Mouse | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 1894 | 941 | 35 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5311053 | 941 | 35 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL37853 | 941 | 35 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| DB11507 | 941 | 35 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 134157766 | 153504 | 0 | None | -1 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3984438 | 153504 | 0 | None | -1 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 134149776 | 147959 | 0 | None | 43 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3938300 | 147959 | 0 | None | 43 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 134151657 | 152568 | 0 | None | 1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3976382 | 152568 | 0 | None | 1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 1959 | 652 | 34 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| 5283081 | 652 | 34 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3914661 | 652 | 34 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| 1884 | 3022 | 46 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| 5280363 | 3022 | 46 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| 912 | 3022 | 46 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| CHEMBL815 | 3022 | 46 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| DB12789 | 3022 | 46 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| 13174090 | 151586 | 8 | None | -17 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 388 | 11 | 3 | 5 | 2.8 | O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3967903 | 151586 | 8 | None | -17 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 388 | 11 | 3 | 5 | 2.8 | O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
| 14429703 | 141828 | 0 | None | -5248 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 467 | 12 | 4 | 7 | 1.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3889508 | 141828 | 0 | None | -5248 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 467 | 12 | 4 | 7 | 1.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393462 | 66498 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL186192 | 66498 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44393438 | 65818 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL184264 | 65818 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 71552665 | 86635 | 0 | None | - | 1 | Mouse | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 450 | 9 | 4 | 8 | 0.9 | NS(=O)(=O)c1ccc(-n2cc([C@H]3[C@H](O)C[C@H](O)[C@@H]3C/C=C\CCCC(=O)O)nn2)cc1 | 10.1016/j.bmcl.2012.12.058 | ||
| CHEMBL2326219 | 86635 | 0 | None | - | 1 | Mouse | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 450 | 9 | 4 | 8 | 0.9 | NS(=O)(=O)c1ccc(-n2cc([C@H]3[C@H](O)C[C@H](O)[C@@H]3C/C=C\CCCC(=O)O)nn2)cc1 | 10.1016/j.bmcl.2012.12.058 | ||
| 6438324 | 66343 | 2 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL185484 | 66343 | 2 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 68749474 | 145688 | 0 | None | -1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3920347 | 145688 | 0 | None | -1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393448 | 65234 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL183193 | 65234 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44393474 | 122464 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL360869 | 122464 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 1884 | 3022 | 46 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 5280363 | 3022 | 46 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 912 | 3022 | 46 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL815 | 3022 | 46 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| DB12789 | 3022 | 46 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 1884 | 3022 | 46 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 5280363 | 3022 | 46 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 912 | 3022 | 46 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL815 | 3022 | 46 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| DB12789 | 3022 | 46 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 44393451 | 167676 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL433752 | 167676 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1883 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| 1916 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| 5280360 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| 913 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| CHEMBL548 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| DB00917 | 3021 | 71 | None | -162 | 10 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
| 44393422 | 123873 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL363946 | 123873 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 56839536 | 142625 | 0 | None | -15 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
| CHEMBL3896035 | 142625 | 0 | None | -15 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
| 56839342 | 148463 | 0 | None | -26 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
| CHEMBL3942394 | 148463 | 0 | None | -26 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
| 68747479 | 151577 | 0 | None | -7 | 2 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3967855 | 151577 | 0 | None | -7 | 2 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 134147356 | 149068 | 0 | None | -123 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3947086 | 149068 | 0 | None | -123 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393601 | 64514 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL182117 | 64514 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44564518 | 192556 | 0 | None | - | 1 | Mouse | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL523143 | 192556 | 0 | None | - | 1 | Mouse | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| 1940 | 1625 | 38 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| 3417 | 1625 | 38 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| 5311100 | 1625 | 38 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL1201379 | 1625 | 38 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| DB11519 | 1625 | 38 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
| 68785185 | 150271 | 0 | None | 7 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3956817 | 150271 | 0 | None | 7 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| 1960 | 2244 | 38 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 6441636 | 2244 | 38 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL1050 | 2244 | 38 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 127052613 | 139663 | 0 | None | -39 | 6 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 7 | 3 | 7 | 3.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/[C@@H](O)COc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| CHEMBL3804978 | 139663 | 0 | None | -39 | 6 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 7 | 3 | 7 | 3.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/[C@@H](O)COc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| 5282380 | 124510 | 38 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL364375 | 124510 | 38 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 56649302 | 152122 | 0 | None | -9 | 6 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 630 | 13 | 2 | 7 | 5.5 | O=C(CCc1ccc(F)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
| CHEMBL3972583 | 152122 | 0 | None | -9 | 6 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 630 | 13 | 2 | 7 | 5.5 | O=C(CCc1ccc(F)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
| 56839344 | 151507 | 0 | None | -1202 | 8 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
| CHEMBL3967284 | 151507 | 0 | None | -1202 | 8 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
| 127052614 | 139683 | 0 | None | -97 | 6 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 415 | 7 | 2 | 6 | 4.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| CHEMBL3805176 | 139683 | 0 | None | -97 | 6 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 415 | 7 | 2 | 6 | 4.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| 71552411 | 86617 | 0 | None | - | 1 | Mouse | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 516 | 14 | 5 | 9 | 2.1 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)Nc1nnc(S(N)(=O)=O)s1 | 10.1016/j.bmcl.2012.12.058 | ||
| CHEMBL2325977 | 86617 | 0 | None | - | 1 | Mouse | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 516 | 14 | 5 | 9 | 2.1 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)Nc1nnc(S(N)(=O)=O)s1 | 10.1016/j.bmcl.2012.12.058 | ||
| 6443852 | 153302 | 5 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3982726 | 153302 | 5 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| 134138103 | 147335 | 0 | None | 12 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3933326 | 147335 | 0 | None | 12 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 56839343 | 143735 | 0 | None | -12 | 6 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 642 | 14 | 2 | 8 | 5.4 | COc1ccc(CCC(=O)NS(=O)(=O)C(F)(F)F)c(CN2CCC[C@H]2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | nan | ||
| CHEMBL3904989 | 143735 | 0 | None | -12 | 6 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 642 | 14 | 2 | 8 | 5.4 | COc1ccc(CCC(=O)NS(=O)(=O)C(F)(F)F)c(CN2CCC[C@H]2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | nan | ||
| 44564468 | 192095 | 0 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL521964 | 192095 | 0 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 5311239 | 130083 | 22 | None | 5 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36817 | 130083 | 22 | None | 5 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 9845493 | 186512 | 0 | None | - | 1 | Mouse | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491474 | 186512 | 0 | None | - | 1 | Mouse | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 68747456 | 145221 | 0 | None | 5 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 388 | 8 | 3 | 5 | 2.6 | O=C(O)CCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3916674 | 145221 | 0 | None | 5 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 388 | 8 | 3 | 5 | 2.6 | O=C(O)CCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393420 | 65814 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL184249 | 65814 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44393607 | 97640 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL273444 | 97640 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44393436 | 122455 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL360862 | 122455 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1960 | 2244 | 38 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| 6441636 | 2244 | 38 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| CHEMBL1050 | 2244 | 38 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
| 44564520 | 186197 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL489109 | 186197 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 9825293 | 99580 | 8 | None | 83 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL287080 | 99580 | 8 | None | 83 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 68747472 | 147239 | 0 | None | 7 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 402 | 9 | 3 | 5 | 3.0 | O=C(O)CCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3932636 | 147239 | 0 | None | 7 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 402 | 9 | 3 | 5 | 3.0 | O=C(O)CCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393431 | 66359 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL185559 | 66359 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44564519 | 186513 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491475 | 186513 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| 69753740 | 139679 | 0 | None | -1 | 5 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3805134 | 139679 | 0 | None | -1 | 5 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
| 68751402 | 143693 | 0 | None | -5 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 416 | 10 | 3 | 5 | 3.3 | O=C(O)CCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3904644 | 143693 | 0 | None | -5 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 416 | 10 | 3 | 5 | 3.3 | O=C(O)CCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393457 | 123687 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL363439 | 123687 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1884 | 3022 | 46 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5280363 | 3022 | 46 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 912 | 3022 | 46 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL815 | 3022 | 46 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| DB12789 | 3022 | 46 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 10389527 | 152799 | 15 | None | 1122 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL39784 | 152799 | 15 | None | 1122 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 126495491 | 139682 | 0 | None | -660 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 2 | 6 | 4.5 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| CHEMBL3805169 | 139682 | 0 | None | -660 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 2 | 6 | 4.5 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
| 134144861 | 150136 | 0 | None | 7 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 430 | 11 | 3 | 5 | 3.7 | O=C(O)CCCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| CHEMBL3955821 | 150136 | 0 | None | 7 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 430 | 11 | 3 | 5 | 3.7 | O=C(O)CCCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
| 44393443 | 66340 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL185466 | 66340 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1955 | 16 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5311240 | 16 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36041 | 16 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 6441607 | 154528 | 21 | None | -1 | 4 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL40183 | 154528 | 21 | None | -1 | 4 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 142451571 | 179824 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4752237 | 179824 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| 135357370 | 179631 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4749822 | 179631 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 142451571 | 179824 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4752237 | 179824 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| 142451214 | 179625 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4749767 | 179625 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135357321 | 180006 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4754421 | 180006 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 118948515 | 181934 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 477 | 4 | 2 | 3 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(N)=O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4787228 | 181934 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 477 | 4 | 2 | 3 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(N)=O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 11283 | 579 | 6 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 142451571 | 179824 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4752237 | 179824 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| 162658978 | 180736 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4762787 | 180736 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 118948617 | 178808 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 2 | 3 | 5.3 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2[n+]([O-])c1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4739939 | 178808 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 2 | 3 | 5.3 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2[n+]([O-])c1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 142451618 | 178975 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 565 | 8 | 2 | 4 | 5.8 | Cc1c(N2CC(F)(F)C2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4741813 | 178975 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 565 | 8 | 2 | 4 | 5.8 | Cc1c(N2CC(F)(F)C2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135358158 | 180651 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4761670 | 180651 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL1910324 | 207324 | 0 | None | -1 | 3 | Bovine | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
| CHEMBL1910324 | 207324 | 0 | None | 1 | 3 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
| CHEMBL1910324 | 207324 | 0 | None | -1 | 3 | Sheep | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
| 130405592 | 182147 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 4 | 2 | 2 | 6.7 | Cc1c(-c2ccccc2)cc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4789967 | 182147 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 4 | 2 | 2 | 6.7 | Cc1c(-c2ccccc2)cc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 130405404 | 180159 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 456 | 4 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(C(C)(C)C)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4756068 | 180159 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 456 | 4 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(C(C)(C)C)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 162659434 | 180656 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4761725 | 180656 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
| 118948371 | 180844 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 460 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4764092 | 180844 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 460 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 162653447 | 179907 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 459 | 5 | 0 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)N(C)CCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4753259 | 179907 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 459 | 5 | 0 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)N(C)CCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| 118948324 | 179267 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 498 | 4 | 2 | 3 | 6.4 | O=C(O)c1ccc(NC(=O)c2c(Cl)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4745363 | 179267 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 498 | 4 | 2 | 3 | 6.4 | O=C(O)c1ccc(NC(=O)c2c(Cl)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| 162671048 | 182215 | 0 | None | 2 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4790821 | 182215 | 0 | None | 2 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 142451214 | 179625 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4749767 | 179625 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 162655188 | 180125 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C)c1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4755674 | 180125 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C)c1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| 135357254 | 181182 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1cccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4777724 | 181182 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1cccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| 118948280 | 179763 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 434 | 4 | 2 | 3 | 6.0 | Cc1c(-c2ccccc2)nc2ccc(Cl)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4751462 | 179763 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 434 | 4 | 2 | 3 | 6.0 | Cc1c(-c2ccccc2)nc2ccc(Cl)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 162644141 | 181248 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4778430 | 181248 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| 162655888 | 180160 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 464 | 5 | 2 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1CNc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4756085 | 180160 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 464 | 5 | 2 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1CNc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 162659434 | 180656 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4761725 | 180656 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
| 162671748 | 182218 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 465 | 5 | 1 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1COc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4790875 | 182218 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 465 | 5 | 1 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1COc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 135357370 | 179631 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4749822 | 179631 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 118947820 | 180146 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 478 | 4 | 2 | 3 | 6.1 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4755942 | 180146 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 478 | 4 | 2 | 3 | 6.1 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 118948258 | 180517 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 504 | 5 | 2 | 3 | 6.6 | O=C(O)c1ccc(NC(=O)c2c(C3CC3)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4760232 | 180517 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 504 | 5 | 2 | 3 | 6.6 | O=C(O)c1ccc(NC(=O)c2c(C3CC3)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
| 135357195 | 179057 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4743035 | 179057 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135357378 | 179183 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4744552 | 179183 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 162649924 | 179523 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4748513 | 179523 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 135357378 | 179183 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4744552 | 179183 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135357195 | 179057 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4743035 | 179057 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 142451544 | 181774 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4784864 | 181774 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135357321 | 180006 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4754421 | 180006 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 142451565 | 181334 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4779694 | 181334 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 130405858 | 180450 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 494 | 4 | 2 | 4 | 5.2 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2c(=O)n1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4759438 | 180450 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 494 | 4 | 2 | 4 | 5.2 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2c(=O)n1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 142451544 | 181774 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4784864 | 181774 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 162651877 | 179659 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 502 | 4 | 2 | 5 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(-c2nnn[nH]2)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4750252 | 179659 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 502 | 4 | 2 | 5 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(-c2nnn[nH]2)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 142451565 | 181334 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4779694 | 181334 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 162664851 | 181542 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC(C)Cc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4782206 | 181542 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC(C)Cc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
| 130405401 | 179689 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 526 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(I)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4750703 | 179689 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 526 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(I)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 122551092 | 182082 | 1 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC12CCC(C(=O)O)(CC1)CC2 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4789100 | 182082 | 1 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC12CCC(C(=O)O)(CC1)CC2 | 10.1021/acs.jmedchem.0c00834 | ||
| 162651613 | 179695 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | Cc1c(N2CCCC2)nc2ccc(Br)cc2c1C(=O)NC[C@@H](CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4750758 | 179695 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | Cc1c(N2CCCC2)nc2ccc(Br)cc2c1C(=O)NC[C@@H](CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 142451571 | 179824 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4752237 | 179824 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
| 135357792 | 179080 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4743411 | 179080 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135357792 | 179080 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4743411 | 179080 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
| 135358158 | 180651 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4761670 | 180651 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
| 118948479 | 181569 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 468 | 4 | 2 | 3 | 6.3 | Cc1c(-c2ccccc2)nc2ccc(C(F)(F)F)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4782468 | 181569 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 468 | 4 | 2 | 3 | 6.3 | Cc1c(-c2ccccc2)nc2ccc(C(F)(F)F)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
| 10402929 | 57224 | 0 | None | - | 0 | Human | 4.4 | pKi | = | 4.4 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
| CHEMBL166351 | 57224 | 0 | None | - | 0 | Human | 4.4 | pKi | = | 4.4 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
| 44377464 | 119567 | 0 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
| CHEMBL350832 | 119567 | 0 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
| 9817405 | 164840 | 2 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
| CHEMBL423815 | 164840 | 2 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
| 1884 | 3022 | 46 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 7452 | 3666 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 4 | 3.8 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/C(COc1ccccc1)(F)F)O | 15037111 | ||
| 9978917 | 3666 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 4 | 3.8 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/C(COc1ccccc1)(F)F)O | 15037111 | ||
| 3386 | 320 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 5 | 3.2 | OC(=O)CC/C=C\CC[C@@H]1[C@@H](/C=C/[C@H](COc2cccc(c2)Cl)O)OC[C@@H]1O | 17076623 | ||
| 59107184 | 320 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 5 | 3.2 | OC(=O)CC/C=C\CC[C@@H]1[C@@H](/C=C/[C@H](COc2cccc(c2)Cl)O)OC[C@@H]1O | 17076623 | ||
| 1956 | 322 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| 1956 | 322 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| 5311238 | 322 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| 5311238 | 322 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| CHEMBL1332680 | 322 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| CHEMBL1332680 | 322 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
| 1958 | 651 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
| 371 | 651 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
| 5311027 | 651 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
| CHEMBL1200963 | 651 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
| DB00905 | 651 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
| 50902259 | 2883 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| 9875 | 2883 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| CHEMBL4297633 | 2883 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| DB12043 | 2883 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| 1959 | 652 | 34 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
| 5283081 | 652 | 34 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
| CHEMBL3914661 | 652 | 34 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
| 1955 | 16 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 | ||
| 5311240 | 16 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 | ||
| CHEMBL36041 | 16 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 | ||
| Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Affinity) |
# tested GPCRs (Affinity) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
| 1955 | 16 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5311240 | 16 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36041 | 16 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 1894 | 941 | 35 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5311053 | 941 | 35 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL37853 | 941 | 35 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| DB11507 | 941 | 35 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 9825293 | 99580 | 8 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL287080 | 99580 | 8 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 44354547 | 116066 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 390 | 12 | 5 | 4 | 2.7 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)O | 10.1021/jm010264b | ||
| CHEMBL336543 | 116066 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 390 | 12 | 5 | 4 | 2.7 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)O | 10.1021/jm010264b | ||
| 44571206 | 183397 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 574 | 6 | 1 | 5 | 6.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc3ccccc3c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL481813 | 183397 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 574 | 6 | 1 | 5 | 6.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc3ccccc3c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 10047541 | 131976 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 416 | 13 | 4 | 6 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccs1 | 10.1021/jm990542v | ||
| CHEMBL369797 | 131976 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 416 | 13 | 4 | 6 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccs1 | 10.1021/jm990542v | ||
| 11283 | 579 | 6 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 44322535 | 204886 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 12 | 5 | 7 | 3.2 | [N-]=[N+]=Nc1cc(O)cc(OC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c1 | 10.1021/jm00121a046 | ||
| CHEMBL89096 | 204886 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 12 | 5 | 7 | 3.2 | [N-]=[N+]=Nc1cc(O)cc(OC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c1 | 10.1021/jm00121a046 | ||
| 102305175 | 24671 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 374 | 12 | 4 | 4 | 3.0 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCC[PH](=O)O | 10.1021/jm010264b | ||
| CHEMBL134546 | 24671 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 374 | 12 | 4 | 4 | 3.0 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCC[PH](=O)O | 10.1021/jm010264b | ||
| 15486805 | 165489 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | ||
| CHEMBL425681 | 165489 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | ||
| 11283 | 579 | 6 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 1884 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 5280363 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 912 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| CHEMBL815 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| DB12789 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 162671048 | 182215 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4790821 | 182215 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
| 10740699 | 59743 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 417 | 13 | 4 | 7 | 3.2 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1nccs1 | 10.1021/jm990542v | ||
| CHEMBL173811 | 59743 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 417 | 13 | 4 | 7 | 3.2 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1nccs1 | 10.1021/jm990542v | ||
| 6441607 | 154528 | 21 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL40183 | 154528 | 21 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 44285252 | 120567 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL35715 | 120567 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 44570666 | 182678 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 4.5 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3ccc(F)c(F)c3)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL479664 | 182678 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 4.5 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3ccc(F)c(F)c3)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 10670992 | 59726 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 444 | 13 | 4 | 5 | 4.4 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(Cl)c1 | 10.1021/jm990542v | ||
| CHEMBL173680 | 59726 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 444 | 13 | 4 | 5 | 4.4 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(Cl)c1 | 10.1021/jm990542v | ||
| 11283 | 579 | 6 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 44565193 | 176276 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL461390 | 176276 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44564804 | 176116 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL459885 | 176116 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 1894 | 941 | 35 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | ||
| 5311053 | 941 | 35 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | ||
| CHEMBL37853 | 941 | 35 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | ||
| DB11507 | 941 | 35 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | ||
| 5311234 | 114628 | 19 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
| CHEMBL334398 | 114628 | 19 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 1955 | 16 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | ||
| 5311240 | 16 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | ||
| CHEMBL36041 | 16 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | ||
| 44322596 | 164337 | 0 | None | - | 0 | Bovine | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL422242 | 164337 | 0 | None | - | 0 | Bovine | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 44285208 | 99437 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 13 | 4 | 5 | 3.4 | N#Cc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL286132 | 99437 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 13 | 4 | 5 | 3.4 | N#Cc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 44285328 | 130916 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(F)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36911 | 130916 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(F)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| 44285199 | 99723 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1C(F)(F)F | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL288277 | 99723 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1C(F)(F)F | 10.1016/s0960-894x(00)00273-0 | ||
| 11283 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 44564990 | 192039 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(F)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL521777 | 192039 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(F)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44322613 | 204755 | 0 | None | - | 0 | Bovine | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL88275 | 204755 | 0 | None | - | 0 | Bovine | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 44564571 | 186223 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL489310 | 186223 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44190762 | 176296 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | ||
| CHEMBL461571 | 176296 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | ||
| 44571290 | 182650 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 542 | 6 | 1 | 5 | 5.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL479633 | 182650 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 542 | 6 | 1 | 5 | 5.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 10741197 | 59681 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(F)c1 | 10.1021/jm990542v | ||
| CHEMBL173499 | 59681 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(F)c1 | 10.1021/jm990542v | ||
| 44285251 | 161967 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL416784 | 161967 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| 10251023 | 59631 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 410 | 13 | 4 | 5 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1ccccc1 | 10.1021/jm990542v | ||
| CHEMBL173299 | 59631 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 410 | 13 | 4 | 5 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1ccccc1 | 10.1021/jm990542v | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | ||
| 10981979 | 116102 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 388 | 12 | 4 | 4 | 3.5 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(C)(=O)O | 10.1021/jm010264b | ||
| CHEMBL336781 | 116102 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 388 | 12 | 4 | 4 | 3.5 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(C)(=O)O | 10.1021/jm010264b | ||
| 44564937 | 178646 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL472754 | 178646 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44564841 | 179773 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3F)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL475152 | 179773 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3F)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44322613 | 204755 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL88275 | 204755 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 10648334 | 59358 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 478 | 13 | 4 | 5 | 4.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(C(F)(F)F)c1 | 10.1021/jm990542v | ||
| CHEMBL172250 | 59358 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 478 | 13 | 4 | 5 | 4.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(C(F)(F)F)c1 | 10.1021/jm990542v | ||
| 44322611 | 204862 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | ||
| CHEMBL88974 | 204862 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | ||
| 5311239 | 130083 | 22 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1021/jm990542v | ||
| CHEMBL36817 | 130083 | 22 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1021/jm990542v | ||
| 44322291 | 205085 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| CHEMBL90450 | 205085 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| 44564893 | 179931 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL475349 | 179931 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44157014 | 192007 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 518 | 6 | 1 | 5 | 5.9 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc4ccccc4c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL521609 | 192007 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 518 | 6 | 1 | 5 | 5.9 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc4ccccc4c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 44285161 | 99882 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(C(F)(F)F)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL289660 | 99882 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(C(F)(F)F)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| 25195248 | 182343 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 4.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL479263 | 182343 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 4.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 11133176 | 23970 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 402 | 13 | 4 | 4 | 3.9 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CC | 10.1021/jm010264b | ||
| CHEMBL133945 | 23970 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 402 | 13 | 4 | 4 | 3.9 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CC | 10.1021/jm010264b | ||
| 1283333 | 91090 | 7 | None | - | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 8 | 1 | 3 | 4.7 | CCc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1016/j.bmcl.2006.12.060 | ||
| CHEMBL240436 | 91090 | 7 | None | - | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 8 | 1 | 3 | 4.7 | CCc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1016/j.bmcl.2006.12.060 | ||
| 10001608 | 99872 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL289568 | 99872 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 9888589 | 168544 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.0 | CP(=O)(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
| CHEMBL440164 | 168544 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.0 | CP(=O)(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
| 44571352 | 183442 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 504 | 6 | 1 | 4 | 4.3 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)cc(F)c3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL482158 | 183442 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 504 | 6 | 1 | 4 | 4.3 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)cc(F)c3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | ||
| 44285145 | 99967 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL290571 | 99967 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | ||
| 44564892 | 179930 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| CHEMBL475348 | 179930 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | ||
| 71458087 | 79138 | 0 | None | - | 0 | Bovine | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL2114229 | 79138 | 0 | None | - | 0 | Bovine | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 11283 | 579 | 6 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 5311239 | 130083 | 22 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36817 | 130083 | 22 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 44285209 | 130858 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 14 | 4 | 4 | 4.1 | CCc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL36901 | 130858 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 14 | 4 | 4 | 4.1 | CCc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 15486806 | 100008 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1021/jm990542v | ||
| CHEMBL290969 | 100008 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1021/jm990542v | ||
| 44285270 | 152346 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL39746 | 152346 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 46879894 | 6089 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 6 | 1 | 5 | 7.2 | Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(-c3cc(NS(=O)(=O)c4ccc(F)c(F)c4)no3)cc(F)cc12 | 10.1016/j.bmcl.2009.09.084 | ||
| CHEMBL1081186 | 6089 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 6 | 1 | 5 | 7.2 | Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(-c3cc(NS(=O)(=O)c4ccc(F)c(F)c4)no3)cc(F)cc12 | 10.1016/j.bmcl.2009.09.084 | ||
| 44571291 | 189553 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 554 | 7 | 1 | 6 | 5.3 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL517377 | 189553 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 554 | 7 | 1 | 6 | 5.3 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | ||
| 44322588 | 106540 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 445 | 12 | 5 | 6 | 3.7 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c(O)c1 | 10.1021/jm00121a046 | ||
| CHEMBL315519 | 106540 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 445 | 12 | 5 | 6 | 3.7 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c(O)c1 | 10.1021/jm00121a046 | ||
| 10741017 | 60944 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 424 | 13 | 4 | 5 | 4.0 | Cc1cccc(SCC(O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1021/jm990542v | ||
| CHEMBL176692 | 60944 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 424 | 13 | 4 | 5 | 4.0 | Cc1cccc(SCC(O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1021/jm990542v | ||
| 44285146 | 134697 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL37244 | 134697 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
| 44571354 | 183477 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 516 | 7 | 1 | 5 | 4.2 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4ccc(F)c(F)c4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL482330 | 183477 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 516 | 7 | 1 | 5 | 4.2 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4ccc(F)c(F)c4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | ||
| 71450954 | 79139 | 0 | None | - | 0 | Bovine | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL2114230 | 79139 | 0 | None | - | 0 | Bovine | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 11133782 | 23934 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 15 | 4 | 4 | 4.6 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CCCC | 10.1021/jm010264b | ||
| CHEMBL133910 | 23934 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 15 | 4 | 4 | 4.6 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CCCC | 10.1021/jm010264b | ||
| 71449156 | 79136 | 0 | None | - | 0 | Bovine | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| CHEMBL2114224 | 79136 | 0 | None | - | 0 | Bovine | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | ||
| 44322611 | 204862 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | ||
| CHEMBL88974 | 204862 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | ||
| 44322291 | 205085 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| CHEMBL90450 | 205085 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | ||
| 71450954 | 79139 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| CHEMBL2114230 | 79139 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | ||
| 44570668 | 183425 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1cccc(Cl)c1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL482018 | 183425 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1cccc(Cl)c1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 9909510 | 99842 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1F | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL289373 | 99842 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1F | 10.1016/s0960-894x(00)00273-0 | ||
| 44570712 | 182486 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(Cl)cc1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| CHEMBL479439 | 182486 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(Cl)cc1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | ||
| 10389527 | 152799 | 15 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL39784 | 152799 | 15 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 10389527 | 152799 | 15 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL39784 | 152799 | 15 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
| 15486806 | 100008 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/s0960-894x(00)00273-0 | ||
| CHEMBL290969 | 100008 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/s0960-894x(00)00273-0 | ||
| 10739351 | 167742 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 13 | 5 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CNc1ccccc1 | 10.1021/jm990542v | ||
| CHEMBL434173 | 167742 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 13 | 5 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CNc1ccccc1 | 10.1021/jm990542v | ||
| 122522051 | 152467 | 10 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 4.3 | CC(C)[C@H](N)C(=O)OCC[C@H](NC(=O)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 | nan | ||
| CHEMBL3975522 | 152467 | 10 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 4.3 | CC(C)[C@H](N)C(=O)OCC[C@H](NC(=O)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 | nan | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | ||
| 44564518 | 192556 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL523143 | 192556 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| 53358922 | 64084 | 0 | None | -229 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813276 | 64084 | 0 | None | -229 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
| 1884 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 5280363 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 912 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL815 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| DB12789 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 1884 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 5280363 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 912 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL815 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| DB12789 | 3022 | 46 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 44564468 | 192095 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL521964 | 192095 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 9895436 | 106520 | 0 | None | -72 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
| CHEMBL315391 | 106520 | 0 | None | -72 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
| 44564520 | 186197 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL489109 | 186197 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 53358921 | 64095 | 0 | None | -295 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813287 | 64095 | 0 | None | -295 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
| 11597294 | 165612 | 4 | None | -16982 | 8 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
| CHEMBL426387 | 165612 | 4 | None | -16982 | 8 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
| 44393448 | 65234 | 0 | None | - | 1 | Bovine | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL183193 | 65234 | 0 | None | - | 1 | Bovine | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 11283 | 579 | 6 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 146368333 | 579 | 6 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
| 10277744 | 64066 | 0 | None | -60 | 7 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813116 | 64066 | 0 | None | -60 | 7 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| 10228100 | 64068 | 0 | None | -295 | 5 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813118 | 64068 | 0 | None | -295 | 5 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| 10181606 | 204618 | 0 | None | -676 | 7 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | ||
| CHEMBL87371 | 204618 | 0 | None | -676 | 7 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | ||
| 10551015 | 109610 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | ||
| CHEMBL323591 | 109610 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | ||
| 15948325 | 2480 | 39 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
| 5856 | 2480 | 39 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
| CHEMBL402162 | 2480 | 39 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
| 10116116 | 64065 | 0 | None | -269 | 5 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813115 | 64065 | 0 | None | -269 | 5 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| 11476788 | 160715 | 0 | None | -147 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
| CHEMBL412070 | 160715 | 0 | None | -147 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
| 10185612 | 64067 | 0 | None | -75 | 4 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813117 | 64067 | 0 | None | -75 | 4 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| 11743212 | 16967 | 0 | None | -7244 | 7 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | ||
| CHEMBL125588 | 16967 | 0 | None | -7244 | 7 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | ||
| 24765153 | 183937 | 0 | None | -39810 | 8 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
| CHEMBL484778 | 183937 | 0 | None | -39810 | 8 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
| 10299717 | 64071 | 0 | None | -758 | 6 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL1813120 | 64071 | 0 | None | -758 | 6 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
| 44393607 | 97640 | 0 | None | - | 1 | Bovine | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL273444 | 97640 | 0 | None | - | 1 | Bovine | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1894 | 941 | 35 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | ||
| 5311053 | 941 | 35 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | ||
| CHEMBL37853 | 941 | 35 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | ||
| DB11507 | 941 | 35 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | ||
| 44393462 | 66498 | 0 | None | - | 1 | Bovine | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL186192 | 66498 | 0 | None | - | 1 | Bovine | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 10116114 | 125352 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| CHEMBL364841 | 125352 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
| 10116114 | 125352 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | ||
| CHEMBL364841 | 125352 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | ||
| 44393420 | 65814 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL184249 | 65814 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 15947857 | 154963 | 8 | None | -301 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | ||
| CHEMBL404199 | 154963 | 8 | None | -301 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | ||
| 44393431 | 66359 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL185559 | 66359 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 9939791 | 161357 | 0 | None | -316 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | ||
| CHEMBL415310 | 161357 | 0 | None | -316 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | ||
| 11488860 | 19080 | 0 | None | -9999 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
| CHEMBL1290413 | 19080 | 0 | None | -9999 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
| 9809136 | 106393 | 0 | None | -501 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
| CHEMBL314533 | 106393 | 0 | None | -501 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
| 44393422 | 123873 | 0 | None | - | 1 | Bovine | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL363946 | 123873 | 0 | None | - | 1 | Bovine | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 6438324 | 66343 | 2 | None | - | 1 | Bovine | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL185484 | 66343 | 2 | None | - | 1 | Bovine | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 9938626 | 205096 | 0 | None | -331 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
| CHEMBL90491 | 205096 | 0 | None | -331 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
| 10717894 | 166428 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | ||
| CHEMBL428794 | 166428 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | ||
| 10217804 | 150297 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 8 | 2 | 5 | 3.8 | O=C(N[C@@H](CCO)c1ccc(F)cc1)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1 | nan | ||
| CHEMBL3957115 | 150297 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 8 | 2 | 5 | 3.8 | O=C(N[C@@H](CCO)c1ccc(F)cc1)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1 | nan | ||
| 9874010 | 205451 | 0 | None | -363 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
| CHEMBL92539 | 205451 | 0 | None | -363 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
| 44393601 | 64514 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL182117 | 64514 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 25003075 | 6745 | 12 | None | -22908 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | ||
| CHEMBL1084009 | 6745 | 12 | None | -22908 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | ||
| 44393474 | 122464 | 0 | None | - | 1 | Bovine | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL360869 | 122464 | 0 | None | - | 1 | Bovine | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
| 9845493 | 186512 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491474 | 186512 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 9868867 | 186529 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491667 | 186529 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
| 44393438 | 65818 | 0 | None | - | 1 | Bovine | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL184264 | 65818 | 0 | None | - | 1 | Bovine | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44393451 | 167676 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL433752 | 167676 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 44564519 | 186513 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL491475 | 186513 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
| 44393436 | 122455 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL360862 | 122455 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 5282380 | 124510 | 38 | None | - | 1 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL364375 | 124510 | 38 | None | - | 1 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
| 1960 | 2244 | 38 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 6441636 | 2244 | 38 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| CHEMBL1050 | 2244 | 38 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
| 44393457 | 123687 | 0 | None | - | 1 | Bovine | 5.0 | pKi | = | 5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| CHEMBL363439 | 123687 | 0 | None | - | 1 | Bovine | 5.0 | pKi | = | 5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
| 3356 | 2239 | 68 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
| 4326 | 2239 | 68 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
| 9867642 | 2239 | 68 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
| CHEMBL426559 | 2239 | 68 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
| DB11629 | 2239 | 68 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
| 11283 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | ||
| 146368333 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | ||
| CHEMBL4643852 | 579 | 6 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 67861203 | 214284 | 0 | 3H-PGF2Alpha | 9 | 8 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 424 | 11 | 4 | 5 | 3.2 | C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O | None | ||
| 1940 | 1625 | 38 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 3417 | 1625 | 38 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 5311100 | 1625 | 38 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| CHEMBL1201379 | 1625 | 38 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| DB11519 | 1625 | 38 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 1883 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1916 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 5280360 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 913 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| CHEMBL548 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| DB00917 | 3021 | 71 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| None | 214268 | 0 | 3H-PGF2Alpha | -1 | 3 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 512 | 11 | 2 | 4 | 4.6 | C1CC2C(C(C1O2)CC=CCCCC(=O)O)C=CC(COC3=CC=C(C=C3)I)O | None | ||
| 1888 | 3825 | 26 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 1974 | 3825 | 26 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 5311493 | 3825 | 26 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| CHEMBL521784 | 3825 | 26 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 91798918 | 214282 | 0 | 3H-PGF2Alpha | -147 | 10 | Bovine | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 119461 | 317 | 66 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | ||
| 1896 | 317 | 66 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | ||
| CHEMBL1317823 | 317 | 66 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | ||
| 119304 | 739 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 1878 | 739 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 40481312 | 739 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| CHEMBL575504 | 739 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 122021 | 743 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | ||
| 1897 | 743 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | ||
| 1899 | 743 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | ||
| 1817 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 1936 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 5282381 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| CHEMBL606 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| DB00929 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 138 | 3020 | 84 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
| 1882 | 3020 | 84 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
| 5280723 | 3020 | 84 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
| CHEMBL495 | 3020 | 84 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
| DB00770 | 3020 | 84 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
| 1980 | 3592 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
| 1985 | 3592 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
| 6437074 | 3592 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
| 5311035 | 97341 | 27 | 3H-PGF2Alpha | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | ||
| CHEMBL271896 | 97341 | 27 | 3H-PGF2Alpha | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | ||
| 133126726 | 214264 | 0 | 3H-PGF2Alpha | -954 | 14 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 24868263 | 214264 | 0 | 3H-PGF2Alpha | -954 | 14 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| None | 214270 | 0 | 3H-PGF2Alpha | -5248 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 587 | 15 | 3 | 8 | 4.7 | C1C(C(C(C1=O)CCC=CCCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)OCC(COC4=CC=CC=C4)O)O | None | ||
| None | 214286 | 0 | 3H-PGF2Alpha | -1 | 2 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 400 | 9 | 3 | 4 | 3.4 | CC1CCCCC1C(C=CC2C(CC(C2CC=CCOCC(=O)O)Cl)O)O | None | ||
| None | 214289 | 0 | 3H-PGF2Alpha | 1 | 2 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 150 | 1 | 0 | 4 | 1.3 | C1N(CSCS1)N=O | None | ||
| 132748 | 214655 | 0 | 3H-PGF2Alpha | -7 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 3 | 2 | 4 | 4.6 | C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CCC4=CC=NC=C4)C=C(C=C3)Cl.Cl | None | ||
| None | 214657 | 0 | 3H-PGF2Alpha | -10 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 477 | 11 | 1 | 5 | 5.1 | C1CC(=O)CC1CCC(=CCC(C(=O)O)N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4 | None | ||
| 1883 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1916 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 5280360 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 913 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| CHEMBL548 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| DB00917 | 3021 | 71 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1884 | 3022 | 46 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 133126726 | 214264 | 0 | 3H-PGF2Alpha | -114 | 14 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 24868263 | 214264 | 0 | 3H-PGF2Alpha | -114 | 14 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 1913 | 2419 | 0 | 3H-PGF2Alpha | -870 | 15 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | ||
| 5311223 | 2419 | 0 | 3H-PGF2Alpha | -870 | 15 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | ||
| 1917 | 912 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| 5311044 | 912 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| 631 | 912 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| CHEMBL160629 | 912 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| None | 214656 | 0 | 3H-PGF2Alpha | -5495 | 6 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 384 | 9 | 3 | 3 | 4.3 | C1CCC(CC1)C(C=CC2C(CC(C2CC=CCCCC(=O)O)Cl)O)O | None | ||
| 119304 | 739 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 1878 | 739 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 40481312 | 739 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| CHEMBL575504 | 739 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | ||
| 134689669 | 214269 | 0 | 3H-PGF2Alpha | -19 | 12 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 1940 | 1625 | 38 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 3417 | 1625 | 38 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 5311100 | 1625 | 38 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| CHEMBL1201379 | 1625 | 38 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| DB11519 | 1625 | 38 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 1551 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 1961 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 5311221 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| CHEMBL1051 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| DB00654 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 1888 | 3825 | 26 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 1974 | 3825 | 26 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 5311493 | 3825 | 26 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| CHEMBL521784 | 3825 | 26 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 1881 | 3018 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1891 | 3018 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 448457 | 3018 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL1235252 | 3018 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB02056 | 3018 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 134689669 | 214269 | 0 | 3H-PGF2Alpha | -1380 | 12 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 1884 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1884 | 3022 | 46 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1940 | 1625 | 38 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 3417 | 1625 | 38 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 5311100 | 1625 | 38 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| CHEMBL1201379 | 1625 | 38 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| DB11519 | 1625 | 38 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | ||
| 67861203 | 214284 | 0 | 3H-PGF2Alpha | -66 | 8 | Bovine | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 424 | 11 | 4 | 5 | 3.2 | C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O | None | ||
| 1883 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1916 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 5280360 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 913 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| CHEMBL548 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| DB00917 | 3021 | 71 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| None | 214290 | 0 | 3H-PGF2Alpha | 2 | 2 | Bovine | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCCC=CCC1C(CC(C1CCC(CCC2=CC=CC=C2)O)O)O | None | ||
| 133126726 | 214264 | 0 | 3H-PGF2Alpha | -40 | 14 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 24868263 | 214264 | 0 | 3H-PGF2Alpha | -40 | 14 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 1881 | 3018 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1891 | 3018 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 448457 | 3018 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL1235252 | 3018 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB02056 | 3018 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1884 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 3356 | 2239 | 68 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
| 4326 | 2239 | 68 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
| 9867642 | 2239 | 68 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
| CHEMBL426559 | 2239 | 68 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
| DB11629 | 2239 | 68 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
| 1958 | 651 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | ||
| 371 | 651 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | ||
| 5311027 | 651 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | ||
| CHEMBL1200963 | 651 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | ||
| DB00905 | 651 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | ||
| 1913 | 2419 | 0 | 3H-PGF2Alpha | -3630 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | ||
| 5311223 | 2419 | 0 | 3H-PGF2Alpha | -3630 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | ||
| 1551 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 1961 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 5311221 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| CHEMBL1051 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| DB00654 | 2245 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 134689669 | 214269 | 0 | 3H-PGF2Alpha | -316 | 12 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| None | 214287 | 0 | 3H-PGF2Alpha | 1 | 2 | Bovine | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 424 | 16 | 2 | 5 | 5.1 | CCCCCCCC(=O)CCC1C(CC(C1CC=CCCCC(=O)OC(C)C)O)O | None | ||
| 138107701 | 186871 | 39 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
| 5311181 | 186871 | 39 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
| CHEMBL494 | 186871 | 39 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
| 1551 | 2245 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 1961 | 2245 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 5311221 | 2245 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| CHEMBL1051 | 2245 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| DB00654 | 2245 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 134689669 | 214269 | 0 | None | -19 | 12 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 1881 | 3018 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1891 | 3018 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 448457 | 3018 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL1235252 | 3018 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB02056 | 3018 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1884 | 3022 | 46 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 5280363 | 3022 | 46 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 912 | 3022 | 46 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| CHEMBL815 | 3022 | 46 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| DB12789 | 3022 | 46 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
| 1883 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1916 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 5280360 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 913 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| CHEMBL548 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| DB00917 | 3021 | 71 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 89077401 | 214263 | 0 | 3H-PGF2Alpha | -56 | 12 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)C(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | ||
| 1883 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 1916 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 5280360 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 913 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| CHEMBL548 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| DB00917 | 3021 | 71 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
| 11156438 | 2243 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 5261 | 2243 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 9635 | 2243 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| CHEMBL2364612 | 2243 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| DB11660 | 2243 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 1551 | 2245 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 1961 | 2245 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 5311221 | 2245 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| CHEMBL1051 | 2245 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| DB00654 | 2245 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | ||
| 91798918 | 214282 | 0 | None | -3 | 10 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 5282226 | 215996 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC\C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1\C=C\[C@@H](O)COC1=CC(=CC=C1)C(F)(F)F | None | ||
| 91798918 | 214282 | 0 | 3H-PGF2Alpha | -3 | 10 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | ||
| 1888 | 3825 | 26 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 1974 | 3825 | 26 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 5311493 | 3825 | 26 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| CHEMBL521784 | 3825 | 26 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
| 1817 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 1936 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 5282381 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| CHEMBL606 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| DB00929 | 2496 | 60 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| None | 214262 | 0 | 3H-PGF2Alpha | -4 | 5 | Mouse | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 366 | 12 | 2 | 3 | 5.2 | CCCCCC(C=CC1CC2CC(C1CC=CCCCC(=O)O)S2)O | None | ||
| None | 214285 | 0 | 3H-PGF2Alpha | 91 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 390 | 12 | 4 | 4 | 3.3 | C1C(C(C(C1O)CC=CCCCC(=O)O)CCC(CCC2=CC=CC=C2)O)O | None | ||
| 1551 | 2245 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | ||
| 1961 | 2245 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | ||
| 5311221 | 2245 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | ||
| CHEMBL1051 | 2245 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | ||
| DB00654 | 2245 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | ||
| 10152528 | 483 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 515 | 7 | 1 | 5 | 4.7 | O=C([C@@H]1SCCN1S(=O)(=O)c1ccc(cc1)c1ccccc1)N[C@@H](c1ccccn1)c1ccccc1 | 17618756 | ||
| 3424 | 483 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 515 | 7 | 1 | 5 | 4.7 | O=C([C@@H]1SCCN1S(=O)(=O)c1ccc(cc1)c1ccccc1)N[C@@H](c1ccccn1)c1ccccc1 | 17618756 | ||
| 50902259 | 2883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| 9875 | 2883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| CHEMBL4297633 | 2883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| DB12043 | 2883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
| 1940 | 1625 | 38 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
| 3417 | 1625 | 38 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
| 5311100 | 1625 | 38 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
| CHEMBL1201379 | 1625 | 38 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
| DB11519 | 1625 | 38 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
| 1960 | 2244 | 38 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 6441636 | 2244 | 38 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| CHEMBL1050 | 2244 | 38 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 1817 | 2496 | 60 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 1936 | 2496 | 60 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 5282381 | 2496 | 60 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| CHEMBL606 | 2496 | 60 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| DB00929 | 2496 | 60 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | ||
| 1917 | 912 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| 5311044 | 912 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| 631 | 912 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| CHEMBL160629 | 912 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | ||
| 1907 | 2223 | 17 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | ||
| 44403763 | 2223 | 17 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | ||
| CHEMBL370606 | 2223 | 17 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | ||
| 1893 | 781 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | ||
| 5311242 | 781 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | ||
| CHEMBL148319 | 781 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | ||
| 1888 | 3825 | 26 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
| 1974 | 3825 | 26 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
| 5311493 | 3825 | 26 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
| CHEMBL521784 | 3825 | 26 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
| 1895 | 1968 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
| 6435378 | 1968 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
| CHEMBL236025 | 1968 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
| DB01088 | 1968 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
| 1913 | 2419 | 0 | None | -3630 | 15 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | ||
| 5311223 | 2419 | 0 | None | -3630 | 15 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | ||
| 1893 | 781 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
| 5311242 | 781 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
| CHEMBL148319 | 781 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
| 1888 | 3825 | 26 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
| 1974 | 3825 | 26 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
| 5311493 | 3825 | 26 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
| CHEMBL521784 | 3825 | 26 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
| 1883 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 1883 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| 1916 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 1916 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| 5280360 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 5280360 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| 913 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| 913 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| CHEMBL548 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| CHEMBL548 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| DB00917 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
| DB00917 | 3021 | 71 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | ||
| 1919 | 3635 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| 2538 | 3635 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| 5312153 | 3635 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| CHEMBL1472830 | 3635 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| DB12708 | 3635 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| 1913 | 2419 | 0 | None | -870 | 15 | Mouse | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 9313928 | ||
| 5311223 | 2419 | 0 | None | -870 | 15 | Mouse | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 9313928 | ||
| 1938 | 1930 | 14 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
| 5311175 | 1930 | 14 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
| CHEMBL2113346 | 1930 | 14 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
| 1883 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| 1916 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| 5280360 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| 913 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| CHEMBL548 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| DB00917 | 3021 | 71 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | ||
| 1918 | 1531 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| 5311225 | 1531 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| CHEMBL2104194 | 1531 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | ||
| 1881 | 3018 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 1891 | 3018 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 448457 | 3018 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| CHEMBL1235252 | 3018 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| DB02056 | 3018 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 1881 | 3018 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 1891 | 3018 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 448457 | 3018 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| CHEMBL1235252 | 3018 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| DB02056 | 3018 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 1884 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 5280363 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| 912 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| CHEMBL815 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | ||
| DB12789 | 3022 | 46 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | ||
| 1940 | 1625 | 38 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | ||
| 3417 | 1625 | 38 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | ||
| 5311100 | 1625 | 38 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | ||
| CHEMBL1201379 | 1625 | 38 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | ||
| DB11519 | 1625 | 38 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | ||
| 1884 | 3022 | 46 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 5280363 | 3022 | 46 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 912 | 3022 | 46 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| CHEMBL815 | 3022 | 46 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| DB12789 | 3022 | 46 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | ||
| 1894 | 941 | 35 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
| 5311053 | 941 | 35 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
| CHEMBL37853 | 941 | 35 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
| DB11507 | 941 | 35 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
| 11156438 | 2243 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 5261 | 2243 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 9635 | 2243 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| CHEMBL2364612 | 2243 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| DB11660 | 2243 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | ||
| 11156438 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | ||
| 11156438 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | ||
| 5261 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | ||
| 5261 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | ||
| 9635 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | ||
| 9635 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | ||
| CHEMBL2364612 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | ||
| CHEMBL2364612 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | ||
| DB11660 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | ||
| DB11660 | 2243 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | ||