Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50213147'   

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))	BDBM50213147 (4-(1,1-dimethyl-heptyl)-3',5'-dimethyl-biphenyl-2-...) Show SMILES CCCCCCC(C)(C)c1ccc(-c2cc(C)cc(C)c2)c(c1)C(=O)NC(C)C Show InChI InChI=1S/C27H39NO/c1-8-9-10-11-14-27(6,7)23-12-13-24(22-16-20(4)15-21(5)17-22)25(18-23)26(29)28-19(2)3/h12-13,15-19H,8-11,14H2,1-7H3,(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from cloned human CB1 receptor				Bioorg Med Chem Lett 17: 3652-6 (2007) Article DOI: 10.1016/j.bmcl.2007.04.059 BindingDB Entry DOI: 10.7270/Q2GM8703
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