Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50356549'   

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))	BDBM50356549 (CHEMBL1909857) Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1 |(18.71,-36.55,;19.62,-37.8,;21.16,-37.8,;21.63,-39.27,;20.38,-40.17,;19.14,-39.26,;17.67,-39.72,;16.43,-38.79,;16.46,-37.24,;15.17,-39.67,;15.63,-41.15,;17.17,-41.17,;18.05,-42.43,;20.38,-41.71,;19.04,-42.47,;19.04,-44.01,;20.37,-44.79,;20.37,-46.33,;21.71,-44.01,;23.05,-44.78,;21.71,-42.47,;22.06,-36.56,;21.44,-35.15,;23.6,-36.72,;24.5,-35.47,;26.04,-35.46,;26.82,-36.78,;28.35,-36.77,;29.11,-35.43,;30.65,-35.41,;28.32,-34.1,;29.07,-32.76,;26.79,-34.12,)| Show InChI InChI=1S/C22H14Cl6N4O/c1-11-20(21(33)29-10-12-2-4-14(23)16(25)8-12)30-32(13-3-5-15(24)17(26)9-13)22(11)31-18(27)6-7-19(31)28/h2-9H,10H2,1H3,(H,29,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	162	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 expressed in HEK cells				Eur J Med Chem 46: 5641-53 (2011) Article DOI: 10.1016/j.ejmech.2011.09.037 BindingDB Entry DOI: 10.7270/Q2P55NXD
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