Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50138699 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_54926 |
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Ki | 123±n/a nM |
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Citation | Selassie, CD; Fang, ZX; Li, RL; Hansch, C; Debnath, G; Klein, TE; Langridge, R; Kaufman, BT On the structure selectivity problem in drug design. A comparative study of benzylpyrimidine inhibition of vertebrate and bacterial dihydrofolate reductase via molecular graphics and quantitative structure-activity relationships. J Med Chem32:1895-905 (1989) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Dihydrofolate reductase |
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Name: | Dihydrofolate reductase |
Synonyms: | DYR_LACCA | dhfR | folA |
Type: | PROTEIN |
Mol. Mass.: | 18437.08 |
Organism: | Lactobacillus casei |
Description: | ChEMBL_1357878 |
Residue: | 163 |
Sequence: | MTAFLWAQDRDGLIGKDGHLPWHLPDDLHYFRAQTVGKIMVVGRRTYESFPKRPLPERTN
VVLTHQEDYQAQGAVVVHDVAAVFAYAKQHPDQELVIAGGAQIFTAFKDDVDTLLVTRLA
GSFEGDTKMIPLNWDDFTKVSSRTVEDTNPALTHTYEVWQKKA
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BDBM50138699 |
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n/a |
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Name | BDBM50138699 |
Synonyms: | 5-(3-(benzyloxy)-4-methoxybenzyl)pyrimidine-2,4-diamine | 5-(3-Benzyloxy-4-methoxy-benzyl)-pyrimidine-2,4-diamine | CHEMBL291931 |
Type | Small organic molecule |
Emp. Form. | C19H20N4O2 |
Mol. Mass. | 336.3877 |
SMILES | COc1ccc(Cc2cnc(N)nc2N)cc1OCc1ccccc1 |
Structure |
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