Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50356553'   

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))	BDBM50356553 (CHEMBL1909861) Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1 |(18.79,4.76,;18.16,3.35,;19.07,2.1,;20.6,2.1,;21.08,.64,;19.83,-.27,;18.59,.64,;17.12,.19,;15.88,1.12,;15.91,2.66,;14.62,.23,;15.08,-1.24,;16.62,-1.27,;17.09,-2.64,;19.83,-1.8,;18.49,-2.57,;18.49,-4.11,;19.82,-4.88,;19.82,-6.42,;21.16,-4.11,;22.5,-4.87,;21.16,-2.57,;21.51,3.35,;20.89,4.75,;23.04,3.18,;23.95,4.43,;25.49,4.42,;26.25,3.09,;27.78,3.08,;28.56,4.41,;30.1,4.4,;27.79,5.75,;28.56,7.08,;26.25,5.75,)| Show InChI InChI=1S/C25H22Cl4N4O/c1-4-18-23(24(34)30-13-16-7-9-19(26)21(28)11-16)31-33(17-8-10-20(27)22(29)12-17)25(18)32-14(2)5-6-15(32)3/h5-12H,4,13H2,1-3H3,(H,30,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	114	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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