Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA gyrase subunit A/B' and Ligand = 'BDBM50223624'   

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
DNA gyrase subunit A/B (Escherichia coli (strain K12))	BDBM50223624 (CHEMBL95863) Show SMILES CC(C)(C)c1ccc(COc2cccc3[nH]nc(NCCCC(O)=O)c23)cc1 Show InChI InChI=1S/C22H27N3O3/c1-22(2,3)16-11-9-15(10-12-16)14-28-18-7-4-6-17-20(18)21(25-24-17)23-13-5-8-19(26)27/h4,6-7,9-12H,5,8,13-14H2,1-3H3,(H,26,27)(H2,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Dainippon Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibitory activity against Escherichia coli DNA gyrase				Bioorg Med Chem Lett 14: 2857-62 (2004) BindingDB Entry DOI: 10.7270/Q2HH6N85
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