BDBM26261 (2S)-3-(4-chloro-3-fluorophenoxy)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methylpropanamide::C-31::CHEMBL512283::US9278914, S-II

SMILES C[C@](O)(COc1ccc(Cl)c(F)c1)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F

InChI Key InChIKey=SSFVOEAXHZGTRJ-UHFFFAOYSA-N

Data  2 KI  5 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 7 hits for monomerid = 26261   

TargetCytochrome P450 3A4(Human)
University of Tennessee Research Foundation

US Patent
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataIC50: 2.00E+4nMT: 2°CAssay Description:P450 enzyme inhibition was measured using human cDNA-expressed CYP3A4, 2D6, 2C19, 2C9, and 1A2 recombinant enzymes and fluorogenic substrates (coumar...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCytochrome P450 2D6(Human)
University of Tennessee Research Foundation

US Patent
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataIC50: 1.77E+4nMT: 2°CAssay Description:P450 enzyme inhibition was measured using human cDNA-expressed CYP3A4, 2D6, 2C19, 2C9, and 1A2 recombinant enzymes and fluorogenic substrates (coumar...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCytochrome P450 2C19(Human)
University of Tennessee Research Foundation

US Patent
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataIC50: 2.40E+3nMT: 2°CAssay Description:P450 enzyme inhibition was measured using human cDNA-expressed CYP3A4, 2D6, 2C19, 2C9, and 1A2 recombinant enzymes and fluorogenic substrates (coumar...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCytochrome P450 2C9(Human)
University of Tennessee Research Foundation

US Patent
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataIC50: 1.30E+3nMT: 2°CAssay Description:P450 enzyme inhibition was measured using human cDNA-expressed CYP3A4, 2D6, 2C19, 2C9, and 1A2 recombinant enzymes and fluorogenic substrates (coumar...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCytochrome P450 2C9(Human)
University of Tennessee Research Foundation

US Patent
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataIC50: 2.00E+4nMT: 2°CAssay Description:P450 enzyme inhibition was measured using human cDNA-expressed CYP3A4, 2D6, 2C19, 2C9, and 1A2 recombinant enzymes and fluorogenic substrates (coumar...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetAndrogen receptor(Rat)
The Ohio State University

LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataKi:  1.70nM ΔG°:  -11.1kcal/molepH: 7.4 T: 2°CAssay Description:The Ki values were determined by the application of the Cheng-Prusoff equation: Ki = (IC50 x Kd)/(Kd+[L]) where [L] is the concentration of [3H]MIB (...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAndrogen receptor(Human)
Gtx

Curated by ChEMBL
LigandPNGBDBM26261(CHEMBL512283 | (2S)-3-(4-chloro-3-fluorophenoxy)-N...)
Affinity DataKi:  1.70nMAssay Description:Agonist activity at androgen receptorMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed