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Target
Thymidylate kinase
Ligand
BDBM50314836
Substrate
n/a
Meas. Tech.
ChEMBL_793312 (CHEMBL1931815)
Ki
4200±n/a nM
Citation
 Van Poecke, S; Munier-Lehmann, H; Helynck, O; Froeyen, M; Van Calenbergh, S Synthesis and inhibitory activity of thymidine analogues targeting Mycobacterium tuberculosis thymidine monophosphate kinase. Bioorg Med Chem 19:7603-11 (2011) [PubMed]  Article 
Target
Name:
Thymidylate kinase
Synonyms:
KTHY_MYCTU | TMPK | Thymidine monophosphate kinase | dTMP kinase | tmk
Type:
PROTEIN
Mol. Mass.:
22636.29
Organism:
Mycobacterium tuberculosis
Description:
ChEMBL_208218
Residue:
214
Sequence:
MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLASSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWVQRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYAELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
  
Inhibitor
Name:
BDBM50314836
Synonyms:
3'-(4-Phenyl-1,2,3-triazol-1-yl)-3'-deoxythymidine | 3'-Deoxy-3'-(4-phenyl-1,2,3-triazol-1-yl)-beta-D-thymidine | CHEMBL1090132
Type:
Small organic molecule
Emp. Form.:
C18H19N5O4
Mol. Mass.:
369.3746
SMILES:
Cc1cn([C@H]2C[C@@H]([C@@H](CO)O2)n2cc(nn2)-c2ccccc2)c(=O)[nH]c1=O |r|
Structure:
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