Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Ectonucleotide pyrophosphatase/phosphodiesterase family member 1' and Ligand = 'BDBM50304608'   

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))	BDBM50304608 (5,5'-(propane-1,3-diyl)bis(1,3,4-oxadiazole-2(3H)-...) Show SMILES Sc1nnc(CCCc2nnc(S)o2)o1 Show InChI InChI=1S/C7H8N4O2S2/c14-6-10-8-4(12-6)2-1-3-5-9-11-7(15)13-5/h1-3H2,(H,10,14)(H,11,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	1.50E+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))	BDBM50304608 (5,5'-(propane-1,3-diyl)bis(1,3,4-oxadiazole-2(3H)-...) Show SMILES Sc1nnc(CCCc2nnc(S)o2)o1 Show InChI InChI=1S/C7H8N4O2S2/c14-6-10-8-4(12-6)2-1-3-5-9-11-7(15)13-5/h1-3H2,(H,10,14)(H,11,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.67E+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