Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50329134'   

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 2 (Homo sapiens (Human))	BDBM50329134 (1,1,1-trifluoro-N-((1-(2-(2-fluorophenylsulfonyl)p...) Show SMILES Fc1ccccc1S(=O)(=O)c1ncccc1S(=O)(=O)N1CCC(CNS(=O)(=O)C(F)(F)F)CC1 Show InChI InChI=1S/C18H19F4N3O6S3/c19-14-4-1-2-5-15(14)32(26,27)17-16(6-3-9-23-17)33(28,29)25-10-7-13(8-11-25)12-24-34(30,31)18(20,21)22/h1-6,9,13,24H,7-8,10-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	790	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of beta-arrestin binding to recombinant cannabinoid CB2 receptor				Bioorg Med Chem Lett 20: 6785-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.126 BindingDB Entry DOI: 10.7270/Q26Q1XGJ
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