| Reaction Details |
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 | Report a problem with these data |
| Target | Dihydrofolate reductase |
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| Ligand | BDBM50057311 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_54961 (CHEMBL669621) |
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| IC50 | 16700±n/a nM |
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| Citation |  Gangjee, A; Mavandadi, F; Queener, SF Effect of N9-methylation and bridge atom variation on the activity of 5-substituted 2,4-diaminopyrrolo[2,3-d]pyrimidines against dihydrofolate reductases from Pneumocystis carinii and Toxoplasma gondii. J Med Chem40:1173-7 (1997) [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 |
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| Synonyms: | DYR_RAT | Dhfr | Dihydrofolate reductase (DHFR) | Dihydrofolate reductase; P. carinii vs rat | Tetrahydrofolate dehydrogenase |
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| Type: | Enzyme |
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| Mol. Mass.: | 21638.84 |
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| Organism: | Rattus norvegicus (rat) |
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| Description: | n/a |
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| Residue: | 187 |
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| Sequence: | MVRPLNCIVAVSQNMGIGKNGDLPWPLLRNEFKYFQRMTTTSSVEGKQNLVIMGRKTWFS
IPEKNRPLKDRINIVLSRELKEPPQGAHFLAKSLDDALKLIEQPELASKVDMVWVVGGSS
VYQEAMNQPGHLRLFVTRIMQEFESDTFFPEIDLEKYKLLPEYPGVLSEIQEEKGIKYKF
EVYEKKD
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| BDBM50057311 |
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| n/a |
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| Name | BDBM50057311 |
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| Synonyms: | 5-((3,4-dimethoxyphenylthio)methyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine | 5-(3,4-Dimethoxy-phenylsulfanylmethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine | CHEMBL17431 |
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| Type | Small organic molecule |
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| Emp. Form. | C15H17N5O2S |
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| Mol. Mass. | 331.393 |
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| SMILES | COc1ccc(SCc2c[nH]c3nc(N)nc(N)c23)cc1OC |
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| Structure | 
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