Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50176982'   

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
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM50176982 (9-chloro-1-(2',4'-dichlorophenyl)-N-piperidin-1-yl...) Show SMILES Clc1ccc(c(Cl)c1)-n1nc(C(=O)NN2CCCCC2)c2CCCc3ccc(Cl)cc3-c12 Show InChI InChI=1S/C24H23Cl3N4O/c25-16-8-7-15-5-4-6-18-22(24(32)29-30-11-2-1-3-12-30)28-31(23(18)19(15)13-16)21-10-9-17(26)14-20(21)27/h7-10,13-14H,1-6,11-12H2,(H,29,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Sassari Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor in CD1 mouse brain				J Med Chem 48: 7351-62 (2005) Article DOI: 10.1021/jm050317f BindingDB Entry DOI: 10.7270/Q2CF9PNQ
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