BDBM50537705 CHEMBL4640749

SMILES Cn1cnc2n(C)c(=O)n(CCCCC3(C)NC(=O)NC3=O)c(=O)c12

InChI Key InChIKey=SRAANCRTQOBJIA-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50537705   

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

Curated by ChEMBL
LigandPNGBDBM50537705(CHEMBL4640749)
Affinity DataIC50: 6.56E+4nMAssay 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
LigandPNGBDBM50537705(CHEMBL4640749)
Affinity DataIC50: 7.19E+4nMAssay 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
TargetAldo-keto reductase family 1 member B1(Human)
Kyushu University

Curated by ChEMBL
LigandPNGBDBM50537705(CHEMBL4640749)
Affinity DataIC50: 6.56E+4nMAssay Description:Inhibition of human recombinant AKR1B1 assessed as D,L-glyceraldehyde reduction pretreated with 0.3M DMSO followed by compound addition by DMSO-pertu...More 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
LigandPNGBDBM50537705(CHEMBL4640749)
Affinity DataIC50: 1.78E+5nMAssay Description:Inhibition of human recombinant AKR1B1 assessed as D,L-glyceraldehyde reduction pretreated with 0.7M DMSO followed by compound addition by DMSO-pertu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/11/2021
Entry Details Article
PubMed