BDBM50537706 CHEMBL4635409

SMILES [H][C@]12[#6]\[#6](=[#6](/[#6])-[#6])-[#6](=O)-[#6][C@@]1([#6])[#6@@H]2-[#6]-[#6]C1([#6])[#7]-[#6](=O)-[#7]-[#6]1=O

InChI Key InChIKey=CMIXYJLKWMPBSS-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 = 50537706   

TargetAldo-keto reductase family 1 member B1(Human)
Kyushu University

Curated by ChEMBL
LigandPNGBDBM50537706(CHEMBL4635409)
Affinity DataIC50: 2.91E+5nMAssay Description:Inhibition of human recombinant AKR1B1 assessed as D,L-glyceraldehyde reduction incubated in sodium phosphate buffer at pH 6.2 in presence of NADPHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed
TargetAldo-keto reductase family 1 member B1(Human)
Kyushu University

Curated by ChEMBL
LigandPNGBDBM50537706(CHEMBL4635409)
Affinity DataIC50: 4.53E+5nMAssay Description:Aggregation-based inhibition of human recombinant AKR1B1 assessed as D,L-glyceraldehyde reduction incubated in sodium phosphate buffer at pH 6.2 in p...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed