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TargetThymidylate kinase
LigandBDBM50223789
Substrate/Competitorn/a
Meas. Tech.ChEMBL_450257
Ki 5000±n/a nM
Citation Van Daele IMunier-Lehmann HFroeyen MBalzarini JVan Calenbergh S Rational design of 5'-thiourea-substituted alpha-thymidine analogues as thymidine monophosphate kinase inhibitors capable of inhibiting mycobacterial growth. J Med Chem 50:5281-92 (2007) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Thymidylate kinase
Name:Thymidylate kinase
Synonyms:TMPK | Thymidine monophosphate kinase | dTMP kinase
Type:PROTEIN
Mol. Mass.:22636.29
Organism:Mycobacterium tuberculosis
Description:ChEMBL_208218
Residue:214
Sequence:
MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLA
SSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWV
QRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYA
ELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
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  Blast E-value cutoff:
BDBM50223789
n/a
NameBDBM50223789
Synonyms:CHEMBL430363 | N-(3-chloro-4-trifluoromethylphenyl)-N'-[(3'-deoxythymidin-3'-yl)methyl]thiourea
TypeSmall organic molecule
Emp. Form.C19H20ClF3N4O4S
Mol. Mass.492.9
SMILESCc1cn([C@H]2C[C@H](CNC(=S)Nc3ccc(Cl)c(c3)C(F)(F)F)[C@@H](CO)O2)c(=O)[nH]c1=O
Structure
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