Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gastrin/cholecystokinin type B receptor' and Ligand = 'BDBM50046116'   

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 (Homo sapiens (Human))	BDBM50046116 (3-(2-Amino-3-naphthalen-1-yl-propionylamino)-N-{1-...) Show SMILES CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)Cc1cccc2ccccc12 Show InChI InChI=1S/C41H45N5O7/c1-41(2,3)53-40(52)35(22-28-24-43-32-19-10-9-18-30(28)32)46-38(50)33(20-25-12-5-4-6-13-25)45-39(51)34(23-36(47)48)44-37(49)31(42)21-27-16-11-15-26-14-7-8-17-29(26)27/h4-19,24,31,33-35,43H,20-23,42H2,1-3H3,(H,44,49)(H,45,51)(H,46,50)(H,47,48)/t31-,33-,34-,35-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Displacement of [3H]pCCK-8 from cholecystokinin type B receptor in guinea pig brain membrane				J Med Chem 36: 166-72 (1993) BindingDB Entry DOI: 10.7270/Q26M37FJ
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