BDBM50167078 CHEMBL3800198

SMILES Oc1cn(ccc1=O)-c1nccc(c1F)-c1ccccc1

InChI Key InChIKey=GQWSHXNJDYQBLO-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 = 50167078   

TargetLanosterol synthase(Rattus norvegicus)
Merck

Curated by ChEMBL
LigandPNGBDBM50167078(CHEMBL3800198)
Affinity DataIC50:  55nMAssay Description:Inhibition of recombinant human C-terminal His6-tagged MB-COMT expressed in Bacmid using SAM/dopamine as substrate preincubated for 2 hrs followed by...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLanosterol synthase(Rattus norvegicus)
Merck

Curated by ChEMBL
LigandPNGBDBM50167078(CHEMBL3800198)
Affinity DataIC50:  946nMAssay Description:Inhibition of recombinant human C-terminal His6-tagged soluble COMT transfected in Escherichia coli BL21-Gold (DE3) using SAM/dopamine as substrate p...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed