BDBM50542454 CHEMBL4645524

SMILES CC(=O)N1N=C(CC1c1ccc(cc1)C#N)c1cc(O)c(O)c(c1)[N+]([O-])=O

InChI Key InChIKey=WVDFFGFIBOVSNM-UHFFFAOYSA-N

Data  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 3 hits for monomerid = 50542454   

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

Curated by ChEMBL
LigandPNGBDBM50542454(CHEMBL4645524)
Affinity DataIC50: 7.66E+4nMAssay Description:Inhibition of recombinant human MAOA using kynuramine as substrate by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
North-West University

Curated by ChEMBL
LigandPNGBDBM50542454(CHEMBL4645524)
Affinity DataIC50: 8.32E+4nMAssay Description:Inhibition of recombinant human MAOB using kynuramine as substrate by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetCatechol O-methyltransferase(Rat)
North-West University

Curated by ChEMBL
LigandPNGBDBM50542454(CHEMBL4645524)
Affinity DataIC50: 48nMAssay Description:Inhibition of rat liver COMT using esculetin as substrate by fluorescence based spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed