Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ectonucleotide pyrophosphatase/phosphodiesterase family member 2' and Ligand = 'BDBM50322720'   

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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human))	BDBM50322720 (CHEMBL1172921 | methyl4-((4-((3-(4-tert-butylbenzy...) Show SMILES COC(=O)c1ccc(COc2ccc(\C=C3/SC(=O)N(Cc4ccc(cc4)C(C)(C)C)C3=O)cc2OC)cc1 Show InChI InChI=1S/C31H31NO6S/c1-31(2,3)24-13-8-20(9-14-24)18-32-28(33)27(39-30(32)35)17-22-10-15-25(26(16-22)36-4)38-19-21-6-11-23(12-7-21)29(34)37-5/h6-17H,18-19H2,1-5H3/b27-17-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Inhibition of 6x-histidine-tagged human recombinant ATX expressed in HEK293 cells using bisP-nitrophenyl phosphate as a substrate				J Med Chem 53: 4958-67 (2010) Article DOI: 10.1021/jm1005012 BindingDB Entry DOI: 10.7270/Q2G73DXK
					More data for this Ligand-Target Pair