Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50342039'   

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))	BDBM50342039 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES Cc1c(nn(c1-c1ccc(F)cc1)-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C23H20BrFN4O2/c1-15-20(22(30)27-23(14-26)10-12-31-13-11-23)28-29(19-5-3-2-4-18(19)24)21(15)16-6-8-17(25)9-7-16/h2-9H,10-13H2,1H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB2 receptor				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
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