BDBM50587479 CHEMBL5082649

SMILES Cc1ncc2c(n1)[nH]c1c(cccc21)C1CC1

InChI Key InChIKey=CBECJEBESMQTDO-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50587479   

Target[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial(Human)
Central Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50587479(CHEMBL5082649)
Affinity DataIC50: 710nMAssay Description:Inhibition of human recombinant PDHK2 co-complexed with porcine PDH using sodium pyruvate, coenzymeA and NAD as substrates preincubated with enzyme c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
Target[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial(Human)
Central Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50587479(CHEMBL5082649)
Affinity DataIC50: 5.87E+3nMAssay Description:Inhibition of human recombinant PDHK1 co-complexed with porcine PDH using sodium pyruvate, coenzymeA and NAD as substrates preincubated with enzyme c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
Target[3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial(Human)
Central Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50587479(CHEMBL5082649)
Affinity DataIC50: 3.00E+5nMAssay Description:Inhibition of human recombinant BCKDK incubated for 60 mins in presence of ATP by ADP-Glo reagent based luminescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed