BDBM50561480 CHEMBL4791222

SMILES COc1ccc(CNC(=O)c2cccc(c2)C#CC(C)N(O)C(N)=O)c(c1)C(F)(F)F

InChI Key InChIKey=RNKLLMNQYDATBC-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 = 50561480   

TargetBifunctional epoxide hydrolase 2(Human)
Goethe-University of Frankfurt

Curated by ChEMBL
LigandPNGBDBM50561480(CHEMBL4791222)
Affinity DataIC50: 4nMAssay Description:Inhibition of human sEH (1 to 555 residues) expressed in Escherichia coli BL21-(DE3) using PHOME substrate incubated for 30 to 45 mins by fluorescenc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
Goethe-University of Frankfurt

Curated by ChEMBL
LigandPNGBDBM50561480(CHEMBL4791222)
Affinity DataIC50: 1.70E+3nMAssay Description:Inhibition of 5-LOX (unknown origin) expressed in Escherichia coli BL21-(DE3) pre-incubated for 15 mins before AA substrate addition and measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed