BDBM50548131 CHEMBL4747819

SMILES CCC(c1cc(n[nH]1)-c1sc(C)nc1C)c1ccccc1

InChI Key InChIKey=LXLCSCOEVCWPBN-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50548131   

TargetLanosterol synthase(Rat)
F. Hoffmann-La Roche

Curated by ChEMBL
LigandPNGBDBM50548131(CHEMBL4747819)
Affinity DataIC50: 2.10E+4nMAssay Description:Inhibition of recombinant wild-type human COMT expressed in Escherichia coli BL21 using 4-nitrocatechol-Alexa488 as substrate in presence of cofactor...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/22/2022
Entry Details Article
PubMed