Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA gyrase subunit A/B' and Ligand = 'BDBM50491367'   

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 (Staphylococcus aureus)	BDBM50491367 (CHEMBL2382372) Show SMILES COc1ccc2nccc([C@@H](O)CC[C@@H]3CCN(C[C@@H]3C(O)=O)C3CC(C3)c3cc(F)cc(F)c3F)c2c1 |r,wU:10.10,14.13,19.20,(6.38,-22.44,;7.71,-21.66,;9.05,-22.43,;9.04,-23.98,;10.38,-24.75,;11.71,-23.97,;13.05,-24.74,;14.38,-23.96,;14.37,-22.41,;13.04,-21.65,;13.03,-20.11,;11.69,-19.35,;14.36,-19.34,;15.69,-20.1,;17.02,-19.32,;18.36,-20.09,;19.69,-19.32,;19.68,-17.78,;18.35,-17.02,;17.01,-17.79,;15.67,-17.03,;14.34,-17.8,;15.66,-15.49,;21.02,-17.01,;22.51,-17.39,;22.9,-15.88,;21.43,-15.5,;24.22,-15.11,;25.56,-15.87,;26.89,-15.09,;28.23,-15.85,;26.88,-13.55,;25.53,-12.79,;25.51,-11.25,;24.21,-13.57,;22.87,-12.82,;11.71,-22.43,;10.37,-21.66,)| Show InChI InChI=1S/C29H31F3N2O4/c1-38-20-3-4-26-23(14-20)21(6-8-33-26)27(35)5-2-16-7-9-34(15-24(16)29(36)37)19-10-17(11-19)22-12-18(30)13-25(31)28(22)32/h3-4,6,8,12-14,16-17,19,24,27,35H,2,5,7,9-11,15H2,1H3,(H,36,37)/t16-,17?,19?,24+,27+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Staphylococcus aureus DNA gyrase				Bioorg Med Chem Lett 23: 2955-61 (2013) Article DOI: 10.1016/j.bmcl.2013.03.047 BindingDB Entry DOI: 10.7270/Q2KW5JXG
					More data for this Ligand-Target Pair