| Reaction Details |
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 | Report a problem with these data |
| Target | Thymidylate kinase |
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| Ligand | BDBM50223787 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_807092 (CHEMBL1959670) |
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| Ki | 1000±n/a nM |
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| Citation |  Choi, JY; Plummer, MS; Starr, J; Desbonnet, CR; Soutter, H; Chang, J; Miller, JR; Dillman, K; Miller, AA; Roush, WR Structure guided development of novel thymidine mimetics targeting Pseudomonas aeruginosa thymidylate kinase: from hit to lead generation. J Med Chem55:852-70 (2012) [PubMed] Article |
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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 |
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| Synonyms: | KTHY_MYCTU | TMPK | Thymidine monophosphate kinase | dTMP kinase | tmk |
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| Type: | PROTEIN |
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| Mol. Mass.: | 22636.29 |
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| Organism: | Mycobacterium tuberculosis |
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| Description: | ChEMBL_208218 |
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| Residue: | 214 |
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| Sequence: | MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLA
SSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWV
QRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYA
ELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
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| BDBM50223787 |
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| n/a |
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| Name | BDBM50223787 |
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| Synonyms: | CHEMBL235088 | N-(5'-deoxy-alpha-D-thymidin-5'-yl)-N'-(3,4-dichlorophenyl)thiourea |
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| Type | Small organic molecule |
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| Emp. Form. | C17H18Cl2N4O4S |
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| Mol. Mass. | 445.32 |
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| SMILES | Cc1cn([C@@H]2C[C@H](O)[C@@H](CNC(=S)Nc3ccc(Cl)c(Cl)c3)O2)c(=O)[nH]c1=O |
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| Structure | 
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