Brief Information of the Compound and Protein
Compound Name
N-benzyl-2,4-dihydroxy-N-[4-[methyl(quinoxalin-6-ylmethyl)carbamoyl]phenyl]benzamide
    Show/Hide
PubChem ID
CID: 117972517
Canonical SMILES
CN(Cc1ccc2nccnc2c1)C(=O)c1ccc(cc1)N(Cc1ccccc1)C(=O)c1ccc(O)cc1O
    Show/Hide
Compound Formula C31H26N4O4
Compound Structure
Protein Name
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
Atypical protein kinase group
>
Atypical protein kinase PDHK subfamily
Uniprot ID
Q15118
Gene Name
PDK1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000048 PC-3 Homo sapiens (Human)  1
1
IC50 = 5650 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 10 nM
2 IC50 = 62.7 nM
3 Kd = 1 nM
4 Ki = 26 nM