Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Ectonucleotide pyrophosphatase/phosphodiesterase family member 1' and Ligand = 'BDBM50304606'   

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 1 (Homo sapiens (Human))	BDBM50304606 (5-(4-(benzyloxy)phenyl)-1,3,4-oxadiazole-2(3H)-thi...) Show SMILES Sc1nnc(o1)-c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C15H12N2O2S/c20-15-17-16-14(19-15)12-6-8-13(9-7-12)18-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,17,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Noncompetitive inhibition of human recombinant NPP1 by Dixon plot analysis				Bioorg Med Chem 17: 7816-22 (2009) Article DOI: 10.1016/j.bmc.2009.09.011 BindingDB Entry DOI: 10.7270/Q2ZC82X2
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM50304606 (5-(4-(benzyloxy)phenyl)-1,3,4-oxadiazole-2(3H)-thi...) Show SMILES Sc1nnc(o1)-c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C15H12N2O2S/c20-15-17-16-14(19-15)12-6-8-13(9-7-12)18-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,17,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.28E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human recombinant NPP1 assessed as release of p-nitrophenol by microtitre plate spectrophotometry				Bioorg Med Chem 17: 7816-22 (2009) Article DOI: 10.1016/j.bmc.2009.09.011 BindingDB Entry DOI: 10.7270/Q2ZC82X2
					More data for this Ligand-Target Pair