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BDBM50358386 CHEMBL1922878

SMILES: CCCCCCCCCC(=O)C(O)c1ccccc1O

InChI Key: InChIKey=BOPCXKOOFLUVNX-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50358386   
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
CAI-1 autoinducer sensor kinase/phosphatase CqsS


(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM50358386
PNG
(CHEMBL1922878)
Show SMILES CCCCCCCCCC(=O)C(O)c1ccccc1O
Show InChI InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-13-16(19)17(20)14-11-9-10-12-15(14)18/h9-12,17-18,20H,2-8,13H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.72E+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