Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50254834'   

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 (Rattus norvegicus (rat))	BDBM50254834 (2-(1-(4-bromophenyl)-2-(2,4-dichlorophenyl)-5-isop...) Show SMILES CC(C)c1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Br)cc1)-c1nnc(o1)C(C)(C)C Show InChI InChI=1S/C24H23BrCl2N4O/c1-13(2)20-19(22-29-30-23(32-22)24(3,4)5)28-21(17-11-8-15(26)12-18(17)27)31(20)16-9-6-14(25)7-10-16/h6-13H,1-5H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	21.2	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane				Bioorg Med Chem Lett 19: 142-5 (2008) Article DOI: 10.1016/j.bmcl.2008.10.130 BindingDB Entry DOI: 10.7270/Q2T153H8
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