Reaction Details |
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Target | Thymidylate kinase |
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Ligand | BDBM50132298 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_208218 |
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Ki | 97000±n/a nM |
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Citation | Vanheusden, V; Van Rompaey, P; Munier-Lehmann, H; Pochet, S; Herdewijn, P; Van Calenbergh, S Thymidine and thymidine-5'-O-monophosphate analogues as inhibitors of Mycobacterium tuberculosis thymidylate kinase. Bioorg Med Chem Lett13:3045-8 (2003) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Thymidylate kinase |
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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: | MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLA
SSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWV
QRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYA
ELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
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BDBM50132298 |
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n/a |
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Name | BDBM50132298 |
Synonyms: | 1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-5-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione | 1-((2R,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-trifluoromethyl-1H-pyrimidine-2,4-dione | 5-trifluoromethyl-2'-deoxyuridine | CHEMBL1129 | TRIFLURIDINE | Trifluoromethyl Deoxyuridine | Viroptic | cid_6256 | cid_6708818 |
Type | Small organic molecule |
Emp. Form. | C10H11F3N2O5 |
Mol. Mass. | 296.1999 |
SMILES | OC[C@H]1O[C@H](C[C@@H]1O)n1cc(c(=O)[nH]c1=O)C(F)(F)F |r| |
Structure |
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