Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gastrin/cholecystokinin type B receptor' and Ligand = 'BDBM50230686'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Gastrin/cholecystokinin type B receptor (MOUSE)	BDBM50230686 (CHEMBL2021373) Show SMILES OC(=O)CCC(=O)NC(CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 |r,wU:13.13,TLB:37:36:34:31.30.32,THB:37:31:34:28.36.35,27:28:34:31.30.32,32:33:28:31.30.37,32:31:28:33.34.35,(2.59,9.48,;1.07,9.79,;.57,11.25,;.06,8.63,;-1.45,8.92,;-2.48,7.77,;-1.98,6.32,;-3.99,8.09,;-4.47,9.53,;-5.99,9.83,;-7.01,8.68,;-8.52,8.99,;-9.01,10.44,;-9.55,7.83,;-8.21,7.06,;-8.23,5.52,;-9.48,4.63,;-9.01,3.15,;-7.47,3.15,;-6.47,2.02,;-4.96,2.32,;-4.47,3.78,;-5.5,4.92,;-6.99,4.62,;-11.06,8.13,;-12.07,6.97,;-11.57,5.52,;-13.6,7.28,;-14.6,6.13,;-16.1,6.33,;-16.76,4.89,;-16.33,3.37,;-17.64,2.59,;-16.85,4.12,;-17.26,5.55,;-15.46,3.98,;-14.21,4.65,;-14.83,3.18,;-3.46,10.69,;-3.96,12.15,;-2.94,13.3,;-1.42,13,;-.94,11.54,;-1.95,10.38,)| Show InChI InChI=1S/C34H40N4O6/c39-30(10-11-31(40)41)37-29(22-6-2-1-3-7-22)19-36-33(42)28(17-25-18-35-27-9-5-4-8-26(25)27)38-34(43)44-32-23-13-20-12-21(15-23)16-24(32)14-20/h1-9,18,20-21,23-24,28-29,32,35H,10-17,19H2,(H,36,42)(H,37,39)(H,38,43)(H,40,41)/t20?,21?,23?,24?,28-,29?,32?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	355	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Neuroscience Research Centre Curated by ChEMBL					Assay Description Cholecystokinin type B receptor binding assay performed on homogenized cerebral cortex from male mouse				J Med Chem 35: 1572-7 (1992) BindingDB Entry DOI: 10.7270/Q26H4KM8
					More data for this Ligand-Target Pair