Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholecystokinin receptor type A' and Ligand = 'BDBM50286159'   

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
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50286159 (5-(R)-Oxo-5-(4-phenylcarbamoyl-piperidin-1-yl)-4-(...) Show SMILES Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(CC2)C(=O)Nc2ccccc2)c1 Show InChI InChI=1S/C32H36N4O5/c1-23-9-8-14-27(21-23)34-32(40)35-28(15-16-29(37)41-22-24-10-4-2-5-11-24)31(39)36-19-17-25(18-20-36)30(38)33-26-12-6-3-7-13-26/h2-14,21,25,28H,15-20,22H2,1H3,(H,33,38)(H2,34,35,40)/t28-/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity towards binding of [125I]-Bolton-Hunter-CCK-8 to CCKA receptor in guinea pig pancreatic tissue				Bioorg Med Chem Lett 5: 3057-3062 (1995) Article DOI: 10.1016/0960-894X(95)00537-3 BindingDB Entry DOI: 10.7270/Q2BZ6604
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