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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Virulence factor transcriptional regulator MvfR' and Ligand = 'BDBM50512172'   
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
Virulence factor transcriptional regulator MvfR


(Pseudomonas aeruginosa PA14)
BDBM50512172
PNG
(CHEMBL4453677)
Show SMILES CCCCCCS(=O)(=O)c1nccc(n1)-n1ccnn1
Show InChI InChI=1S/C12H17N5O2S/c1-2-3-4-5-10-20(18,19)12-13-7-6-11(15-12)17-9-8-14-16-17/h6-9H,2-5,10H2,1H3
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.00E+4n/an/an/an/an/an/a



Mashhad University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa PqsR


Eur J Med Chem 172: 26-35 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.049
BindingDB Entry DOI: 10.7270/Q2W95DHC
More data for this
Ligand-Target Pair