| Reaction Details |
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 | Report a problem with these data |
| Target | Thymidine kinase |
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| Ligand | BDBM21883 |
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| Substrate/Competitor | BDBM21867 |
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| Meas. Tech. | Thymidine Kinase Inhibition Assay |
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| pH | 7.5±n/a |
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| Temperature | 310.15±n/a K |
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| IC50 | 16500±n/a nM |
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| Km | 1000±n/a nM |
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| Citation |  Manikowski, A; Verri, A; Lossani, A; Gebhardt, BM; Gambino, J; Focher, F; Spadari, S; Wright, GE Inhibition of herpes simplex virus thymidine kinases by 2-phenylamino-6-oxopurines and related compounds: structure-activity relationships and antiherpetic activity in vivo. J Med Chem48:3919-29 (2005) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Thymidine kinase |
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| Name: | Thymidine kinase |
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| Synonyms: | TK |
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| Type: | Transferase |
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| Mol. Mass.: | 40915.49 |
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| Organism: | Human herpesvirus 1 |
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| Description: | O72346 |
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| Residue: | 376 |
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| Sequence: | MASYPCHQHASAFDQAARSRGHSNRRTALRPRRQQEATEVRPEQKMPTLLRVYIDGPHGM
GKTTTTQLLVALGSRDDIVYVPEPMTYWRVLGASETIANIYTTQHRLDQGEISAGDAAVV
MTSAQITMGMPYAVTDAVLAPHIGGEAGSSHAPPPALTLIFDRHPIAALLCYPAARYLMG
SMTPQAVLAFVALIPPTLPGTNIVLGALPEDRHIDRLAKRQRPGERLDLAMLAAIRRVYG
LLANTVRYLQGGGSWREDWGQLSGTAVPPQGAEPQSNAGPRPHIGDTLFTLFRAPELLAP
NGDLYNVFAWALDVLAKRLRPMHVFILDYDQSPAGCRDALLQLTSGMVQTHVTTPGSIPT
ICDLARTFAREMGEAN
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| BDBM21883 |
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| BDBM21867 |
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| Name | BDBM21883 |
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| Synonyms: | 2,9-disubstituted 6-oxopurine, 12g | 2-(phenylamino)-9-{4-[4-(piperidin-1-yl)piperidin-1-yl]butyl}-6,9-dihydro-3H-purin-6-one dihydrochloride |
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| Type | Small organic molecule |
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| Emp. Form. | C25H35N7O |
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| Mol. Mass. | 449.5917 |
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| SMILES | O=c1[nH]c(Nc2ccccc2)nc2n(CCCCN3CCC(CC3)N3CCCCC3)cnc12 |
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| Structure | 
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