Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholecystokinin receptor type A' and Ligand = 'BDBM50013199'   

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)	BDBM50013199 (CHEMBL342415 | N-[5-(2-Fluoro-phenyl)-1-methyl-2,3...) Show SMILES CN1C(CNC(=O)Cc2c[nH]c3ccccc23)CN=C(c2ccccc2F)c2ccccc12 |t:20| Show InChI InChI=1S/C27H25FN4O/c1-32-19(16-30-26(33)14-18-15-29-24-12-6-3-8-20(18)24)17-31-27(21-9-2-5-11-23(21)28)22-10-4-7-13-25(22)32/h2-13,15,19,29H,14,16-17H2,1H3,(H,30,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-CCK-8 to Cholecystokinin type A receptor in rat pancreas				J Med Chem 33: 450-5 (1990) BindingDB Entry DOI: 10.7270/Q26M35TN
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