Reaction Details |
| Report a problem with these data |
Target | Thymidine kinase |
---|
Ligand | BDBM50314844 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_627479 (CHEMBL1111765) |
---|
IC50 | 36000±n/a nM |
---|
Citation | Van Poecke, S; Negri, A; Gago, F; Van Daele, I; Solaroli, N; Karlsson, A; Balzarini, J; Van Calenbergh, S 3'-[4-Aryl-(1,2,3-triazol-1-yl)]-3'-deoxythymidine analogues as potent and selective inhibitors of human mitochondrial thymidine kinase. J Med Chem53:2902-12 (2010) [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
|
|
|
BDBM50314844 |
---|
n/a |
---|
Name | BDBM50314844 |
Synonyms: | 3'-Deoxy-3'-(4-phenyl-1,2,3-triazol-1-yl)-beta-(E)-5-(2-bromovinyl)-2'-deoxyuridine | CHEMBL1091931 |
Type | Small organic molecule |
Emp. Form. | C19H18BrN5O4 |
Mol. Mass. | 460.281 |
SMILES | OC[C@H]1O[C@H](C[C@@H]1n1cc(nn1)-c1ccccc1)n1cc(C=CBr)c(=O)[nH]c1=O |r,w:22.25| |
Structure |
|