Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50332895'   

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))	BDBM50332895 (1-(2,4-Difluorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1...) Show SMILES Cc1ccc(C)n1-c1c(C)c(nn1-c1ccc(F)cc1F)C(=O)NCCC(C)(C)C |(.88,1.17,;.41,-.3,;-1.04,-.77,;-1.05,-2.3,;.42,-2.78,;.89,-4.25,;1.33,-1.55,;2.86,-1.48,;3.4,-.04,;2.57,1.26,;4.92,-.12,;5.33,-1.59,;4.06,-2.44,;4.06,-3.99,;2.73,-4.76,;2.73,-6.3,;4.06,-7.08,;4.06,-8.62,;5.4,-6.3,;5.39,-4.75,;6.74,-3.97,;5.74,1.21,;5.03,2.55,;7.29,1.15,;8.01,-.2,;9.55,-.25,;10.28,-1.61,;9.46,-2.92,;11.82,-1.67,;10.82,-3.05,)| Show InChI InChI=1S/C23H28F2N4O/c1-14-7-8-15(2)28(14)22-16(3)20(21(30)26-12-11-23(4,5)6)27-29(22)19-10-9-17(24)13-18(19)25/h7-10,13H,11-12H2,1-6H3,(H,26,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	163	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from recombinant human CB2 receptor transfected in HEK cells				Eur J Med Chem 45: 5878-86 (2010) Article DOI: 10.1016/j.ejmech.2010.09.053 BindingDB Entry DOI: 10.7270/Q22Z15T3
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