Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50402903'   

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))	BDBM50402903 (CHEMBL2204908) Show SMILES COCCNC(=O)c1c(NC(=O)c2ccccc2Cl)sc2CCCc12 Show InChI InChI=1S/C18H19ClN2O3S/c1-24-10-9-20-17(23)15-12-6-4-8-14(12)25-18(15)21-16(22)11-5-2-3-7-13(11)19/h2-3,5,7H,4,6,8-10H2,1H3,(H,20,23)(H,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Nycomed Pharma Pvt. Ltd Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor after 4 hrs by luciferase reporter gene assay				Bioorg Med Chem Lett 22: 7314-21 (2012) Article DOI: 10.1016/j.bmcl.2012.10.087 BindingDB Entry DOI: 10.7270/Q2QR4Z9V
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