Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50296165'   

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))	BDBM50296165 (CHEMBL564343 | N-isopropyl-N-(2-(4-(4-methoxypheny...) Show SMILES COc1ccc(cc1)C1N(CCc2sccc12)C(=O)CN(C(C)C)C(=O)C1CCCCC1 Show InChI InChI=1S/C26H34N2O3S/c1-18(2)28(26(30)20-7-5-4-6-8-20)17-24(29)27-15-13-23-22(14-16-32-23)25(27)19-9-11-21(31-3)12-10-19/h9-12,14,16,18,20,25H,4-8,13,15,17H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R&D) Ltd Curated by ChEMBL					Assay Description Displacement of [3H]rimonabant from human CB1 receptor expressed in HEK293 cells by liquid scintillation counting				Bioorg Med Chem Lett 19: 4183-90 (2009) Article DOI: 10.1016/j.bmcl.2009.05.114 BindingDB Entry DOI: 10.7270/Q2XP75VT
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