Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peptide deformylase' and Ligand = 'BDBM50100095'   

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
Peptide deformylase (Escherichia coli (strain K12))	BDBM50100095 (2-(5-Chloro-2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-...) Show SMILES ONC(=O)CN1Cc2c(Cl)cccc2NC1=O Show InChI InChI=1S/C10H10ClN3O3/c11-7-2-1-3-8-6(7)4-14(10(16)12-8)5-9(15)13-17/h1-3,17H,4-5H2,(H,12,16)(H,13,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd. Curated by ChEMBL					Assay Description Inhibition of the isolated native E. coli peptide deformylase (PDF)				J Med Chem 44: 1847-52 (2001) BindingDB Entry DOI: 10.7270/Q2ZW1K6C
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