BDBM86772 Phthalonitrile analogue, 4a

SMILES N#Cc1ccc(Oc2ccccc2)cc1C#N

InChI Key InChIKey=CRZSSXUMRNESCC-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 86772   

TargetAmine oxidase [flavin-containing] A(Human)
North-West University

LigandPNGBDBM86772(Phthalonitrile analogue, 4a)
Affinity DataIC50: 2.52E+4nMpH: 7.4 T: 2°CAssay Description:MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2012
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
North-West University

LigandPNGBDBM86772(Phthalonitrile analogue, 4a)
Affinity DataIC50: 6.02E+3nMpH: 7.4 T: 2°CAssay Description:MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2012
Entry Details Article
PubMed