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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'CAI-1 autoinducer sensor kinase/phosphatase CqsS' and Ligand = 'BDBM50358385'   
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
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358385
PNG
(CHEMBL1922877)
Show SMILES CCCCCCCCCC(=O)C(O)c1cccc(CCC)c1
Show InChI InChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-15-19(21)20(22)18-14-11-13-17(16-18)12-4-2/h11,13-14,16,20,22H,3-10,12,15H2,1-2H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



Princeton University

Curated by ChEMBL


Assay Description
Antagonist activity at CqsS receptor in Vibrio cholerae MM920 assessed as inhibition of quorum sensing regulated CAI-1 induced bioluminescence after ...


Bioorg Med Chem 19: 6906-18 (2011)


Article DOI: 10.1016/j.bmc.2011.09.021
More data for this
Ligand-Target Pair