| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Thymidylate synthase |
|---|
| Ligand | BDBM50231341 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEMBL_209653 (CHEMBL811593) |
|---|
| Ki | 16400±n/a nM |
|---|
| Citation |  Pendergast, W; Dickerson, SH; Johnson, JV; Dev, IK; Ferone, R; Duch, DS; Smith, GK Benzoquinazoline inhibitors of thymidylate synthase: enzyme inhibitory activity and cytotoxicity of some sulfonamidobenzoylglutamate and related derivatives. J Med Chem36:3464-71 (1993) [PubMed] |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Thymidylate synthase |
|---|
| Name: | Thymidylate synthase |
|---|
| Synonyms: | TS | TSase | TYMS | TYSY_HUMAN | Thymidylate synthase (TS) | Thymidylate synthase/GAR transformylase/AICAR transformylase |
|---|
| Type: | Enzyme |
|---|
| Mol. Mass.: | 35718.07 |
|---|
| Organism: | Homo sapiens (Human) |
|---|
| Description: | n/a |
|---|
| Residue: | 313 |
|---|
| Sequence: | MPVAGSELPRRPLPPAAQERDAEPRPPHGELQYLGQIQHILRCGVRKDDRTGTGTLSVFG
MQARYSLRDEFPLLTTKRVFWKGVLEELLWFIKGSTNAKELSSKGVKIWDANGSRDFLDS
LGFSTREEGDLGPVYGFQWRHFGAEYRDMESDYSGQGVDQLQRVIDTIKTNPDDRRIIMC
AWNPRDLPLMALPPCHALCQFYVVNSELSCQLYQRSGDMGLGVPFNIASYALLTYMIAHI
TGLKPGDFIHTLGDAHIYLNHIEPLKIQLQREPRPFPKLRILRKVEKIDDFKAEDFQIEG
YNPHPTIKMEMAV
|
|
|
|---|
| BDBM50231341 |
|---|
| n/a |
|---|
| Name | BDBM50231341 |
|---|
| Synonyms: | CHEMBL116508 |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C24H20BrN5O8S |
|---|
| Mol. Mass. | 618.413 |
|---|
| SMILES | [H][C@@](CCC(O)=O)(NC(=O)c1ccc(NS(=O)(=O)c2cc3ccc4nc(N)nc(O)c4c3cc2Br)cc1)C(O)=O |
|---|
| Structure | 
|
|---|
Search and Browse
