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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Autoinducer 1 sensor kinase/phosphatase luxN' and Ligand = 'BDBM50351501'   
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
Autoinducer 1 sensor kinase/phosphatase luxN


(Vibrio harveyi)
BDBM50351501
PNG
(CHEMBL1823948)
Show SMILES Clc1ccc(cc1)C(=O)c1ccc(cc1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H12Cl2O3S/c20-15-5-1-13(2-6-15)19(22)14-3-9-17(10-4-14)25(23,24)18-11-7-16(21)8-12-18/h1-12H
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of LuxN-dependent bioluminescence in Vibrio harveyi


J Med Chem 53: 7467-89 (2010)


Article DOI: 10.1021/jm901742e
BindingDB Entry DOI: 10.7270/Q2S75GPT
More data for this
Ligand-Target Pair