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SMILES: CCNC(=O)Nc1cn(-c2ncc(OC)cn2)c2cc(cnc12)-c1cccnc1

InChI Key: InChIKey=WTCOWCVHNYKOQH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50499037   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
DNA gyrase subunit B


(Staphylococcus aureus)		BDBM50499037
PNG
(CHEMBL3736246)
Show SMILES CCNC(=O)Nc1cn(-c2ncc(OC)cn2)c2cc(cnc12)-c1cccnc1
Show InChI InChI=1S/C20H19N7O2/c1-3-22-20(28)26-16-12-27(19-24-10-15(29-2)11-25-19)17-7-14(9-23-18(16)17)13-5-4-6-21-8-13/h4-12H,3H2,1-2H3,(H2,22,26,28)
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MMDB

KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 143n/an/an/an/an/an/a



Cubist Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus DNA GyraseB ATPase activity using linear pBR322 DNA as substrate incubated for 30 mins by fluorescence polarizati...

J Med Chem 58: 8503-12 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00961
BindingDB Entry DOI: 10.7270/Q24B34BK
More data for this
Ligand-Target Pair