Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50300455'   

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))	BDBM50300455 (3-(4-chlorophenyl)-N'-(4-chlorophenylsulfonyl)-N-m...) Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19| Show InChI InChI=1S/C24H22Cl2N4O2S/c1-27-24(29-33(31,32)21-13-11-20(26)12-14-21)30-16-15-22(17-5-3-2-4-6-17)23(28-30)18-7-9-19(25)10-8-18/h2-14,22H,15-16H2,1H3,(H,27,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description Displacement of [3H]CP-55940 from human CB1 receptor expressed in CHO cells				Bioorg Med Chem Lett 19: 5675-8 (2009) Article DOI: 10.1016/j.bmcl.2009.08.007 BindingDB Entry DOI: 10.7270/Q2J67H0H
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