Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50247390'   

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))	BDBM50247390 (5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-N-(4-met...) Show SMILES CN1CCN(CC1)NC(=O)c1cnn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H20Cl3N5O/c1-27-8-10-28(11-9-27)26-21(30)17-13-25-29(19-7-6-16(23)12-18(19)24)20(17)14-2-4-15(22)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,26,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Genova Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells				Eur J Med Chem 43: 2627-38 (2008) Article DOI: 10.1016/j.ejmech.2008.01.043 BindingDB Entry DOI: 10.7270/Q2ZS2W9S
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