BDBM50178790 1-(3,4-dihydroxy-2-nitrophenyl)-4-phenylbutan-1-one::CHEMBL8476

SMILES Oc1ccc(C(=O)CCCc2ccccc2)c(c1O)[N+]([O-])=O

InChI Key InChIKey=XYLCPJQNLGIUNQ-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50178790   

TargetCatechol O-methyltransferase(Rattus norvegicus (Rat))
Department Of Research & Development

Curated by ChEMBL
LigandPNGBDBM50178790(1-(3,4-dihydroxy-2-nitrophenyl)-4-phenylbutan-1-on...)
Affinity DataIC50:  130nMAssay Description:Inhibitory activity against COMT in rat liverMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCatechol O-methyltransferase(Rattus norvegicus (Rat))
Department Of Research & Development

Curated by ChEMBL
LigandPNGBDBM50178790(1-(3,4-dihydroxy-2-nitrophenyl)-4-phenylbutan-1-on...)
Affinity DataIC50:  4.00E+3nMAssay Description:Inhibitory activity against COMT in rat brainMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed