Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50208964'   

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 (Homo sapiens (Human))	BDBM50208964 (5-bromo-2-(2-chlorophenyl)-1-(4-chlorophenyl)-N-((...) Show SMILES O[C@H]1CCCC[C@@H]1NC(=O)c1nc(-c2ccccc2Cl)n(c1Br)-c1ccc(Cl)cc1 Show InChI InChI=1S/C22H20BrCl2N3O2/c23-20-19(22(30)26-17-7-3-4-8-18(17)29)27-21(15-5-1-2-6-16(15)25)28(20)14-11-9-13(24)10-12-14/h1-2,5-6,9-12,17-18,29H,3-4,7-8H2,(H,26,30)/t17-,18-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bayer HealthCare Curated by ChEMBL					Assay Description Displacement of [3H]CP559440 from human CB1 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2706-11 (2007) Article DOI: 10.1016/j.bmcl.2007.03.011 BindingDB Entry DOI: 10.7270/Q2H70FGB
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