Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50291797 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_54925 (CHEMBL857514) |
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Ki | 4.1±n/a nM |
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Citation | Coats, EA; Genther, CS; Dietrich, SW; Guo, ZR; Hansch, C Comparison of the inhibition of methotrexate-sensitive and -resistant Lactobacillus casei cell cultures with purified Lactobacillus casei dihydrofolate reductase by 4,6-diamino-1,2-dihydro-2,2-dimethyl-1-(3-substituted-phenyl)-s-triazines. Use of quantitative structure-activity relationships in maki J Med Chem24:1422-9 (1981) [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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BDBM50291797 |
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n/a |
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Name | BDBM50291797 |
Synonyms: | 6,6-Dimethyl-1-{3-[2-(3-trifluoromethyl-phenoxy)-ethoxy]-phenyl}-1,6-dihydro-[1,3,5]triazine-2,4-diamine | CHEMBL20628 |
Type | Small organic molecule |
Emp. Form. | C20H22F3N5O2 |
Mol. Mass. | 421.4162 |
SMILES | CC1(C)N=C(N)N=C(N)N1c1cccc(OCCOc2cccc(c2)C(F)(F)F)c1 |t:3,6| |
Structure |
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