BDBM113772 2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2-yl) acetonitrile (4)

SMILES Fc1ccc(cc1)C(C#N)c1cccc(n1)C(F)(F)F

InChI Key InChIKey=DXQNDKQUHKVTTC-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 113772   

TargetAcyl-homoserine lactone acylase PvdQ [A190E,F674L](Pseudomonas aeruginosa)
The Broad Institute , Cambridge, Massachusetts 02142, United States

LigandPNGBDBM113772(2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2...)
Affinity DataIC50: 20nMAssay Description:The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAcyl-homoserine lactone acylase PvdQ(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Helmholtz Institute For Pharmaceutical Research Saarland (HIPS)

Curated by ChEMBL
LigandPNGBDBM113772(2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2...)
Affinity DataIC50: 1.90E+3nMAssay Description:Inhibition of Pseudomonas aeruginosa ATCC 15692 pvdQ measured after 5 minsMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetAcyl-homoserine lactone acylase PvdQ(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Helmholtz Institute For Pharmaceutical Research Saarland (HIPS)

Curated by ChEMBL
LigandPNGBDBM113772(2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2...)
Affinity DataIC50: 1.90E+4nMAssay Description:Inhibition of wild type Pseudomonas aeruginosa PAO1 pvdQMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetAcyl-homoserine lactone acylase PvdQ(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Helmholtz Institute For Pharmaceutical Research Saarland (HIPS)

Curated by ChEMBL
LigandPNGBDBM113772(2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2...)
Affinity DataKi:  190nMAssay Description:Competitive inhibition of Pseudomonas aeruginosa ATCC 15692 pvdQMore data for this Ligand-Target Pair
In DepthDetails
PubMed