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PubMed code 24629449

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
DNA gyrase subunit B


(Staphylococcus aureus)
BDBM50009581
PNG
(CHEMBL3234495)
Show SMILES OC(=O)C[C@@H](N1C(=S)S\C(=C\c2ccc(o2)-c2cc(Cl)ccc2Cl)C1=O)C(O)=O |r|
Show InChI InChI=1S/C18H11Cl2NO6S2/c19-8-1-3-11(20)10(5-8)13-4-2-9(27-13)6-14-16(24)21(18(28)29-14)12(17(25)26)7-15(22)23/h1-6,12H,7H2,(H,22,23)(H,25,26)/b14-6+/t12-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



University of the Sciences

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus DNA gyrase subunit B ATPase activity assessed as consumption of inorganic phosphate by PNP-based absorbance assay


Bioorg Med Chem 22: 2176-87 (2014)


Article DOI: 10.1016/j.bmc.2014.02.020
BindingDB Entry DOI: 10.7270/Q2S18417
More data for this
Ligand-Target Pair
DNA gyrase subunit B


(Staphylococcus aureus)
BDBM50009582
PNG
(CHEMBL3234494)
Show SMILES OC(=O)C[C@@H](N1C(=S)S\C(=C/c2ccccc2Cl)C1=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H14ClNO3S2/c20-14-9-5-4-8-13(14)10-16-18(24)21(19(25)26-16)15(11-17(22)23)12-6-2-1-3-7-12/h1-10,15H,11H2,(H,22,23)/b16-10-/t15-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



University of the Sciences

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus DNA gyrase subunit B ATPase activity assessed as consumption of inorganic phosphate by PNP-based absorbance assay


Bioorg Med Chem 22: 2176-87 (2014)


Article DOI: 10.1016/j.bmc.2014.02.020
BindingDB Entry DOI: 10.7270/Q2S18417
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%