Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholecystokinin receptor type A' and Ligand = 'BDBM50005453'   

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 (RAT)	BDBM50005453 (1H-Indole-2-carboxylic acid [3,3-bis-(4-chloro-phe...) Show SMILES Clc1ccc(cc1)C(=CCNC(=O)c1cc2ccccc2[nH]1)c1ccc(Cl)cc1 |(-.18,1.75,;.59,.41,;2.13,.34,;2.83,-1.01,;1.99,-2.31,;.47,-2.24,;-.23,-.89,;2.71,-3.67,;4.25,-3.74,;5.07,-2.45,;6.61,-2.46,;7.37,-3.79,;6.59,-5.12,;8.91,-3.8,;9.82,-2.55,;11.28,-3.04,;12.61,-2.29,;13.94,-3.06,;13.93,-4.6,;12.58,-5.35,;11.3,-4.7,;9.8,-5.05,;1.87,-4.97,;.33,-4.88,;-.51,-6.19,;.21,-7.57,;-.58,-8.9,;1.76,-7.64,;2.59,-6.33,)| Show InChI InChI=1S/C24H18Cl2N2O/c25-19-9-5-16(6-10-19)21(17-7-11-20(26)12-8-17)13-14-27-24(29)23-15-18-3-1-2-4-22(18)28-23/h1-13,15,28H,14H2,(H,27,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Center for Bio-Pharmaceutical Sciences Curated by ChEMBL					Assay Description Displacement of [3H]-L-364,718 from Cholecystokinin type A receptor of rat pancreatic membranes				J Med Chem 35: 1042-9 (1992) BindingDB Entry DOI: 10.7270/Q2HT2N8R
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