Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50242546'   

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))	BDBM50242546 (CHEMBL488217 | N-tert-Butyl-4-((4-chlorophenyl)(2,...) Show SMILES CC(C)(C)NC(=O)N1CCN(CC1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C22H26Cl3N3O/c1-22(2,3)26-21(29)28-12-10-27(11-13-28)20(15-4-6-16(23)7-5-15)18-9-8-17(24)14-19(18)25/h4-9,14,20H,10-13H2,1-3H3,(H,26,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Central Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor in Sprague-Dawley rat cerebella membrane				Bioorg Med Chem 16: 4035-51 (2008) Article DOI: 10.1016/j.bmc.2008.01.023 BindingDB Entry DOI: 10.7270/Q2B56JH2
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