Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50164433'   

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))	BDBM50164433 (5,5-Bis-(4-bromo-phenyl)-3-isobutyl-2-thioxo-imida...) Show SMILES CC(C)CN1C(=S)NC(C1=O)(c1ccc(Br)cc1)c1ccc(Br)cc1 Show InChI InChI=1S/C19H18Br2N2OS/c1-12(2)11-23-17(24)19(22-18(23)25,13-3-7-15(20)8-4-13)14-5-9-16(21)10-6-14/h3-10,12H,11H2,1-2H3,(H,22,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université catholique de Louvain Curated by ChEMBL					Assay Description Inhibition of [3H]-SR-141,716A binding to human CB1 receptor expressed in CHO cells				J Med Chem 48: 2509-17 (2005) Article DOI: 10.1021/jm049263k BindingDB Entry DOI: 10.7270/Q2Q23ZRD
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