| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Bifunctional dihydrofolate reductase-thymidylate synthase |
|---|
| Ligand | BDBM50291787 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEMBL_55096 (CHEMBL875027) |
|---|
| Ki | 3.388E2±n/a nM |
|---|
| Citation |  Booth, RG; Selassie, CD; Hansch, C; Santi, DV Quantitative structure-activity relationship of triazine-antifolate inhibition of Leishmania dihydrofolate reductase and cell growth. J Med Chem30:1218-24 (1987) [PubMed] |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Bifunctional dihydrofolate reductase-thymidylate synthase |
|---|
| Name: | Bifunctional dihydrofolate reductase-thymidylate synthase |
|---|
| Synonyms: | DHFR-TS | DRTS_LEIMA | Thymidylate synthase (TS) |
|---|
| Type: | Protein |
|---|
| Mol. Mass.: | 58691.04 |
|---|
| Organism: | Leishmania major |
|---|
| Description: | P07382 |
|---|
| Residue: | 520 |
|---|
| Sequence: | MSRAAARFKIPMPETKADFAFPSLRAFSIVVALDMQHGIGDGESIPWRVPEDMTFFKNQT
TLLRNKKPPTEKKRNAVVMGRKTWESVPVKFRPLKGRLNIVLSSKATVEELLAPLPEGQR
AAAAQDVVVVNGGLAEALRLLARPLYCSSIETAYCVGGAQVYADAMLSPCIEKLQEVYLT
RIYATAPACTRFFPFPPENAATAWDLASSQGRRKSEAEGLEFEICKYVPRNHEERQYLEL
IDRIMKTGIVKEDRTGVGTISLFGAQMRFSLRDNRLPLLTTKRVFWRGVCEELLWFLRGE
TSAQLLADKDIHIWDGNGSREFLDSRGLTENKEMDLGPVYGFQWRHFGADYKGFEANYDG
EGVDQIKLIVETIKTNPNDRRLLVTAWNPCALQKMALPPCHLLAQFYVNTDTSELSCMLY
QRSCDMGLGVPFNIASYALLTILIAKATGLRPGELVHTLGDAHVYRNHVDALKAQLERVP
HAFPTLIFKEERQYLEDYELTDMEVIDYVPHPAIKMEMAV
|
|
|
|---|
| BDBM50291787 |
|---|
| n/a |
|---|
| Name | BDBM50291787 |
|---|
| Synonyms: | 6,6-Dimethyl-1-[3-(4-pentyl-phenoxymethyl)-phenyl]-1,6-dihydro-[1,3,5]triazine-2,4-diamine | CHEMBL20922 | xv6,6-Dimethyl-1-[3-(4-pentyl-phenoxymethyl)-phenyl]-1,6-dihydro-[13,5]triazine-2,4-diamine |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C23H31N5O |
|---|
| Mol. Mass. | 393.5251 |
|---|
| SMILES | CCCCCc1ccc(OCc2cccc(c2)N2C(N)=NC(N)=NC2(C)C)cc1 |c:20,23| |
|---|
| Structure | 
|
|---|
Search and Browse
