Target
Transketolase
Ligand
BDBM50230593
Substrate
n/a
Meas. Tech.
ChEMBL_461927 (CHEMBL944774)
EC50
9±n/a nM
Citation
 Le Huerou, YGunawardana, IThomas, AABoyd, SAde Meese, JDewolf, WGonzales, SSHan, MHayter, LKaplan, TLemieux, CLee, PPheneger, JPoch, GRomoff, TTSullivan, FWeiler, SWright, SKLin, J Prodrug thiamine analogs as inhibitors of the enzyme transketolase. Bioorg Med Chem Lett 18:505-8 (2008) [PubMed]  Article 
Target
Name:
Transketolase
Synonyms:
TK | TKT | TKT_HUMAN
Type:
PROTEIN
Mol. Mass.:
67886.43
Organism:
Homo sapiens (Human)
Description:
ChEMBL_468615
Residue:
623
Sequence:
MESYHKPDQQKLQALKDTANRLRISSIQATTAAGSGHPTSCCSAAEIMAVLFFHTMRYKSQDPRNPHNDRFVLSKGHAAPILYAVWAEAGFLAEAELLNLRKISSDLDGHPVPKQAFTDVATGSLGQGLGAACGMAYTGKYFDKASYRVYCLLGDGELSEGSVWEAMAFASIYKLDNLVAILDINRLGQSDPAPLQHQMDIYQKRCEAFGWHAIIVDGHSVEELCKAFGQAKHQPTAIIAKTFKGRGITGVEDKESWHGKPLPKNMAEQIIQEIYSQIQSKKKILATPPQEDAPSVDIANIRMPSLPSYKVGDKIATRKAYGQALAKLGHASDRIIALDGDTKNSTFSEIFKKEHPDRFIECYIAEQNMVSIAVGCATRNRTVPFCSTFAAFFTRAFDQIRMAAISESNINLCGSHCGVSIGEDGPSQMALEDLAMFRSVPTSTVFYPSDGVATEKAVELAANTKGICFIRTSRPENAIIYNNNEDFQVGQAKVVLKSKDDQVTVIGAGVTLHEALAAAELLKKEKINIRVLDPFTIKPLDRKLILDSARATKGRILTVEDHYYEGGIGEAVSSAVVGEPGITVTHLAVNRVPRSGKPAELLKMFGIDRDAIAQAVRGLITKA
  
Inhibitor
Name:
BDBM50230593
Synonyms:
3-(2-amino-6-chloro-pyridin-3-ylmethyl)-5-(2-hydroxy-ethyl)-4-methyl-thiazol-3-ium; chloride | CHEMBL270613 | CHEMBL401948
Type:
Small organic molecule
Emp. Form.:
C12H15ClN3OS
Mol. Mass.:
284.784
SMILES:
Cc1c(CCO)sc[n+]1Cc1ccc(Cl)nc1N
Structure:
Search PDB for entries with ligand similarity: