BDBM50614818 CHEMBL3402037

SMILES COc1ccc(cc1)C(=O)Nc1cccc(c1)-c1nc2ccccc2[nH]1

InChI Key InChIKey=JPVZXDNGPVCEIB-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50614818   

TargetCatechol O-methyltransferase(Human)
Emory University

Curated by ChEMBL
LigandPNGBDBM50614818(CHEMBL3402037)
Affinity DataIC50: 7.30E+4nMAssay Description:Inhibition of S-COMT (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMed