Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50213159'   

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))	BDBM50213159 (4'-(1,1-dimethyl-heptyl)-2'-hydroxy-biphenyl-3-car...) Show SMILES CCCCCCC(C)(C)c1ccc(c(O)c1)-c1cccc(c1)C(O)=O Show InChI InChI=1S/C22H28O3/c1-4-5-6-7-13-22(2,3)18-11-12-19(20(23)15-18)16-9-8-10-17(14-16)21(24)25/h8-12,14-15,23H,4-7,13H2,1-3H3,(H,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	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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