Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '3-hydroxyacyl-[acyl-carrier-protein] dehydratase FabZ' and Ligand = 'BDBM31953'   

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
3-hydroxyacyl-[acyl-carrier-protein] dehydratase FabZ (Helicobacter pylori (Campylobacter pylori))	BDBM31953 (1,3-thiazolidin-5-ylidene derivative, 4q) Show SMILES COCCN1C(=O)\C(S\C1=N\c1cccc(F)c1)=C/c1ccc(o1)-c1ccc(Cl)c(c1)C(=O)OC Show InChI InChI=1S/C25H20ClFN2O5S/c1-32-11-10-29-23(30)22(35-25(29)28-17-5-3-4-16(27)13-17)14-18-7-9-21(34-18)15-6-8-20(26)19(12-15)24(31)33-2/h3-9,12-14H,10-11H2,1-2H3/b22-14+,28-25+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Institute of Materia Medica					Assay Description The enzymatic inhibition assay of HpFabZ was monitored by the spectrophotometric method. The activity of HpFabZ was measured by detection of the decr...				J Med Chem 52: 2465-81 (2009) Article DOI: 10.1021/jm8015602 BindingDB Entry DOI: 10.7270/Q2ZK5F1W
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