GPCRdb

Ligand source activities (1 row/activity)

Potency
Affinity

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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
	16158474	209193	18	None	-	1	Human	10.1	pEC50	=	10.1	Functional	Agonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP levelAgonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP level	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	CHEMBL3039582	209193	18	None	-	1	Human	10.1	pEC50	=	10.1	Functional	Agonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP levelAgonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP level	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	CHEMBL1256314	206913	0	None	-	1	Human	10.0	pEC50	=	10	Functional	Agonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP levelAgonist activity at secretin receptor expressed in CHO cells assessed as increase of cAMP level	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc2cnc[nH]2)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	16158474	209193	18	None	-	1	Human	8.0	pEC50	=	8.0	Functional	NoneNone	Drug Central		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	None
	CHEMBL3039582	209193	18	None	-	1	Human	8.0	pEC50	=	8.0	Functional	NoneNone	Drug Central		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	None
	1155	3504	0	None	5	7	Human	9.7	pEC50	=	9.7	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	7612008
	16129665	3504	0	None	5	7	Human	9.7	pEC50	=	9.7	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	7612008
	3643	3504	0	None	5	7	Human	9.7	pEC50	=	9.7	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	7612008
	CHEMBL1201488	3504	0	None	5	7	Human	9.7	pEC50	=	9.7	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	7612008
	DB00021	3504	0	None	5	7	Human	9.7	pEC50	=	9.7	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	7612008
	1152	3920	13	None	-3090	8	Human	5.4	pIC50	=	5.4	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	16129679	3920	13	None	-3090	8	Human	5.4	pIC50	=	5.4	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	53395115	3920	13	None	-3090	8	Human	5.4	pIC50	=	5.4	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	91898389	3920	13	None	-3090	8	Human	5.4	pIC50	=	5.4	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	CHEMBL1981592	3920	13	None	-3090	8	Human	5.4	pIC50	=	5.4	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	1156	3506	0	None	-	1	Rat	5.0	pIC50	None	5	Functional	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711

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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
	CHEMBL1256314	206913	0	None	-	1	Human	8.0	pKi	=	8.0	Binding	Displacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysisDisplacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysis	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc2cnc[nH]2)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	16158474	209193	18	None	-	1	Human	8.5	pKi	=	8.5	Binding	Displacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysisDisplacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysis	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	CHEMBL3039582	209193	18	None	-	1	Human	8.5	pKi	=	8.5	Binding	Displacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysisDisplacement of [125I]-secretin-27 from secretin receptor expressed in CHO cells by gamma-spectrometer analysis	ChEMBL		None	None	None		CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(N)=O)C(C)C	10.1016/j.bmcl.2010.08.062
	1152	3920	13	None	-	4	Rat	6.2	pIC50	=	6.2	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	16129679	3920	13	None	-	4	Rat	6.2	pIC50	=	6.2	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	53395115	3920	13	None	-	4	Rat	6.2	pIC50	=	6.2	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	91898389	3920	13	None	-	4	Rat	6.2	pIC50	=	6.2	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	CHEMBL1981592	3920	13	None	-	4	Rat	6.2	pIC50	=	6.2	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	3293	465	0	None	-	0	Rat	7.7	pIC50	=	7.7	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	1155	3504	0	None	3162	2	Rat	9.0	pIC50	=	9	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	16129665	3504	0	None	3162	2	Rat	9.0	pIC50	=	9	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	3643	3504	0	None	3162	2	Rat	9.0	pIC50	=	9	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	CHEMBL1201488	3504	0	None	3162	2	Rat	9.0	pIC50	=	9	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	DB00021	3504	0	None	3162	2	Rat	9.0	pIC50	=	9	Binding	Inhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptorInhibition of [125I]Tyr25 secretin binding in membranes from CHO cells expressing recombinant receptor	Guide to Pharmacology		None	None	None		None	9437714
	3755	909	0	None	-	1	Human	5.3	pKi	=	5.3	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1702423
	2943	3503	0	None	-	1	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	10383421
	2943	3503	0	None	-	1	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	9694908
	1155	3504	0	None	3162	2	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	16129665	3504	0	None	3162	2	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	3643	3504	0	None	3162	2	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	CHEMBL1201488	3504	0	None	3162	2	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711
	DB00021	3504	0	None	3162	2	Rat	8.5	pKi	=	8.5	Binding	UnclassifiedUnclassified	Guide to Pharmacology		None	None	None		None	1646711

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Ligand source activities (1 row/activity)