Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50164437'   

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))	BDBM50164437 (5,5-Bis-(4-bromo-phenyl)-3-isopropyl-2-thioxo-imid...) Show SMILES CC(C)N1C(=S)NC(C1=O)(c1ccc(Br)cc1)c1ccc(Br)cc1 Show InChI InChI=1S/C18H16Br2N2OS/c1-11(2)22-16(23)18(21-17(22)24,12-3-7-14(19)8-4-12)13-5-9-15(20)10-6-13/h3-11H,1-2H3,(H,21,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.63E+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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