Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Myeloperoxidase' and Ligand = 'BDBM50210144'   

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
Myeloperoxidase (Homo sapiens (Human))	BDBM50210144 (CHEMBL3885290) Show SMILES OC\C=N\NC(=O)c1ccncc1 Show InChI InChI=1S/C8H9N3O2/c12-6-5-10-11-8(13)7-1-3-9-4-2-7/h1-5,12H,6H2,(H,11,13)/b10-5+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Libre de Bruxelles (ULB) Curated by ChEMBL					Assay Description Inhibition of human MPO				ACS Med Chem Lett 8: 206-210 (2017) Article DOI: 10.1021/acsmedchemlett.6b00417 BindingDB Entry DOI: 10.7270/Q28K7C3H
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