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TargetThymidine kinase
LigandBDBM50200999
Substrate/Competitorn/a
Meas. Tech.ChEMBL_422917 (CHEMBL908768)
IC50 25000±n/a nM
Citation Hernandez, AIFamiliar, ONegri, ARodríguez-Barrios, FGago, FKarlsson, ACamarasa, MJBalzarini, JPérez-Pérez, MJ N1-substituted thymine derivatives as mitochondrial thymidine kinase (TK-2) inhibitors. J Med Chem49:7766-73 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Thymidine kinase
Name:Thymidine kinase
Synonyms:KITH_HHV1 | TK | UL23
Type:PROTEIN
Mol. Mass.:40902.47
Organism:Human herpesvirus 1 (strain SC16) (HHV-1) (Human herpes simplex virus1)
Description:ChEMBL_474154
Residue:376
Sequence:
MASYPCHQHASAFDQAARSRGHSNRRTALRPRRQQEATEVRLEQKMPTLLRVYIDGPHGM
GKTTTTQLLVALGSRDDIVYVPEPMTYWQVLGASETIANIYTTQHRLDQGEISAGDAAVV
MTSAQITMGMPYAVTDAVLAPHIGGEAGSSHAPPPALTLIFDRHPIAALLCYPAARYLMG
SMTPQAVLAFVALIPPTLPGTNIVLGALPEDRHIDRLAKRQRPGERLDLAMLAAIRRVYG
LLANTVRYLQGGGSWREDWGQLSGTAVPPQGAEPQSNAGPRPHIGDTLFTLFRAPELLAP
NGDLYNVFAWALDVLAKRLRPMHVFILDYDQSPAGCRDALLQLTSGMVQTHVTTPGSIPT
ICDLARTFAREMGEAN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50200999
n/a
NameBDBM50200999
Synonyms:1-[(Z)-4-[1,1-(diphenyl)-1-(4-pyridyl)methoxy]-2-buten-1-yl]thymine | CHEMBL373998
TypeSmall organic molecule
Emp. Form.C27H25N3O3
Mol. Mass.439.5057
SMILESCc1cn(C\C=C/COC(c2ccccc2)(c2ccccc2)c2ccncc2)c(=O)[nH]c1=O
Structure
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