BDBM50621674 CHEMBL5414200

SMILES Fc1ccc-2c(c1)C1(NC(=O)NC1=O)c1cc(F)cc(OCC(=O)N3CCC3)c-21

InChI Key InChIKey=HHMJRGBMFABNSZ-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 = 50621674   

TargetAldo-keto reductase family 1 member B1(Human)
Case Western Reserve University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50621674(CHEMBL5414200)
Affinity DataIC50: 18nMAssay Description:Inhibition of C-terminal 6His-tagged human recombinant AKR1B1 expressed in Escherichia coli BL21-CodonPlus competent cells using methyl glyoxylate as...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/16/2024
Entry Details
PubMed
TargetAldo-keto reductase family 1 member A1(Human)
Case Western Reserve University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50621674(CHEMBL5414200)
Affinity DataIC50: 59nMAssay Description:Inhibition of C-terminal 6His-tagged human recombinant SCoR2 AKR1A1 expressed in Escherichia coli BL21-CodonPlus competent cells using SNO-CoA as sub...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/16/2024
Entry Details
PubMed