Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholecystokinin receptor type A' and Ligand = 'BDBM50023144'   

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)	BDBM50023144 (4-Chloro-N-[6-(2-fluoro-phenyl)-4H-2,3,5,10b-tetra...) Show SMILES Fc1ccccc1C1=NC(NC(=O)c2ccc(Cl)cc2)c2nncn2-c2ccccc12 |t:8| Show InChI InChI=1S/C23H15ClFN5O/c24-15-11-9-14(10-12-15)23(31)28-21-22-29-26-13-30(22)19-8-4-2-6-17(19)20(27-21)16-5-1-3-7-18(16)25/h1-13,21H,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]-CCK from Cholecystokinin receptor of rat pancreas				J Med Chem 31: 176-81 (1988) BindingDB Entry DOI: 10.7270/Q2ZS2VH2
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