Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50145793 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_54772 (CHEMBL667995) |
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IC50 | 31±n/a nM |
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Citation | Rosowsky, A; Fu, H; Chan, DC; Queener, SF Synthesis of 2,4-diamino-6-[2'-O-(omega-carboxyalkyl)oxydibenz[b,f]azepin-5-yl]methylpteridines as potent and selective inhibitors of Pneumocystis carinii, Toxoplasma gondii, and Mycobacterium avium dihydrofolate reductase. J Med Chem47:2475-85 (2004) [PubMed] Article |
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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: | DHFR | DYR_HUMAN | Dihydrofolate reductase (DHFR) | Tetrahydrofolate dehydrogenase |
Type: | Enzyme |
Mol. Mass.: | 21453.99 |
Organism: | Homo sapiens (Human) |
Description: | Recombinant human DHFR. |
Residue: | 187 |
Sequence: | MVGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFS
IPEKNRPLKGRINLVLSRELKEPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSS
VYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLPEYPGVLSDVQEEKGIKYKF
EVYEKND
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BDBM50145793 |
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n/a |
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Name | BDBM50145793 |
Synonyms: | 5-((2,4-diaminopteridin-6-yl)methyl)-5H-dibenzo[b,f]azepin-2-ol | 5-(2,4-Diamino-pteridin-6-ylmethyl)-5H-dibenzo[b,f]azepin-2-ol | CHEMBL81995 |
Type | Small organic molecule |
Emp. Form. | C21H17N7O |
Mol. Mass. | 383.406 |
SMILES | Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4cc(O)ccc34)cnc2n1 |c:17| |
Structure |
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