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PubMed code 22432682

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
Quinolone resistance protein NorA


(Staphylococcus aureus)
BDBM50386656
PNG
(CHEMBL2048632)
Show SMILES [O-][N+](=O)c1ccc(cc1)-n1nc(c2NS(=O)(=O)c3ccccc3-c12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H13ClN4O4S/c22-14-7-5-13(6-8-14)19-20-21(17-3-1-2-4-18(17)31(29,30)24-20)25(23-19)15-9-11-16(12-10-15)26(27)28/h1-12,24H
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Perugia

Curated by ChEMBL


Assay Description
Inhibition of norA-mediated EtBr efflux in Staphylococcus aureus SA1199B overexpressing norA and expressing A116E GrlA mutation by fluorometry


J Med Chem 55: 3568-72 (2012)


Article DOI: 10.1021/jm201446h
BindingDB Entry DOI: 10.7270/Q2HD7WQ7
More data for this
Ligand-Target Pair
Quinolone resistance protein NorA


(Staphylococcus aureus)
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Perugia

Curated by ChEMBL


Assay Description
Inhibition of norA-mediated EtBr efflux in Staphylococcus aureus SA1199B overexpressing norA and expressing A116E GrlA mutation by fluorometry


J Med Chem 55: 3568-72 (2012)


Article DOI: 10.1021/jm201446h
BindingDB Entry DOI: 10.7270/Q2HD7WQ7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%