Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50110758 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_53614 |
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Ki | 18197±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: | 1.5.1.3 | DHFR | DYR_CHICK |
Type: | n/a |
Mol. Mass.: | 21652.69 |
Organism: | Gallus gallus (Chicken) |
Description: | n/a |
Residue: | 189 |
Sequence: | VRSLNSIVAVCQNMGIGKDGNLPWPPLRNEYKYFQRMTSTSHVEGKQNAVIMGKKTWFSI
PEKNRPLKDRINIVLSRELKEAPKGAHYLSKSLDDALALLDSPELKSKVDMVWIVGGTAV
YKAAMEKPINHRLFVTRILHEFESDTFFPEIDYKDFKLLTEYPGVPADIQEEDGIQYKFE
VYQKSVLAQ
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BDBM50110758 |
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n/a |
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Name | BDBM50110758 |
Synonyms: | 5-(4-(benzyloxy)-3-ethoxybenzyl)pyrimidine-2,4-diamine | 5-(4-Benzyloxy-3-ethoxy-benzyl)-pyrimidine-2,4-diamine | CHEMBL21395 |
Type | Small organic molecule |
Emp. Form. | C20H22N4O2 |
Mol. Mass. | 350.4143 |
SMILES | CCOc1cc(Cc2cnc(N)nc2N)ccc1OCc1ccccc1 |
Structure |
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