Reaction Details
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial
Ligand
BDBM227594
Substrate
n/a
Meas. Tech.
ChEMBL_1659265 (CHEMBL4008877)
IC50
800±n/a nM
Citation
Brough, PA; Baker, L; Bedford, S; Brown, K; Chavda, S; Chell, V; D'Alessandro, J; Davies, NG; Davis, B; Le Strat, L; Macias, AT; Maddox, D; Mahon, PC; Massey, AJ; Matassova, N; McKenna, S; Meissner, JW; Moore, JD; Murray, JB; Northfield, CJ; Parry, C; Parsons, R; Roughley, SD; Shaw, T; Simmonite, H; Stokes, S; Surgenor, A; Stefaniak, E; Robertson, A; Wang, Y; Webb, P; Whitehead, N; Wood, M Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase. J Med Chem 60:2271-2286 (2017) [PubMed] Article More Info.:
Target
Name:
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial
Synonyms:
PDHK2 | PDK2 | PDK2_HUMAN | Pyruvate dehydrogenase kinase 2 (PDK2) | Pyruvate dehydrogenase kinase isoenzyme 1 (PDK2)
Type:
Enzyme
Mol. Mass.:
46153.78
Organism:
Homo sapiens (Human)
Description:
Q15119
Residue:
407
Sequence:
MRWVWALLKNASLAGAPKYIEHFSKFSPSPLSMKQFLDFGSSNACEKTSFTFLRQELPVRLANIMKEINLLPDRVLSTPSVQLVQSWYVQSLLDIMEFLDKDPEDHRTLSQFTDALVTIRNRHNDVVPTMAQGVLEYKDTYGDDPVSNQNIQYFLDRFYLSRISIRMLINQHTLIFDGSTNPAHPKHIGSIDPNCNVSEVVKDAYDMAKLLCDKYYMASPDLEIQEINAANSKQPIHMVYVPSHLYHMLFELFKNAMRATVESHESSLILPPIKVMVALGEEDLSIKMSDRGGGVPLRKIERLFSYMYSTAPTPQPGTGGTPLAGFGYGLPISRLYAKYFQGDLQLFSMEGFGTDAVIYLKALSTDSVERLPVYNKSAWRHYQTIQEAGDWCVPSTEPKNTSTYRVS
Inhibitor
Name:
BDBM227594
Synonyms:
PS10
Type:
Small organic molecule
Emp. Form.:
C14H13NO6S
Mol. Mass.:
323.321
SMILES:
Oc1ccc(c(O)c1)S(=O)(=O)N1Cc2cc(O)cc(O)c2C1
Structure:
