Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50254639'   

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))	BDBM50254639 (2-(1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-met...) Show SMILES Cc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1)-c1nnc(s1)C1CCCCCC1 Show InChI InChI=1S/C25H23Cl3N4S/c1-15-22(25-31-30-24(33-25)16-6-4-2-3-5-7-16)29-23(20-13-10-18(27)14-21(20)28)32(15)19-11-8-17(26)9-12-19/h8-14,16H,2-7H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	21.6	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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