Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0S1VJ
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| Former ID |
DNC003541
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| Drug Name |
8-(3,5-dimethoxyphenyl)-9H-purine-2,6-diamine
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| Synonyms |
8-(3,5-dimethoxyphenyl)-9H-purine-2,6-diamine; CHEMBL105323; AC1LAR96; CTK6J9242; BDBM50059940; 2,6-Diamino-8-(3',5'-dimethoxyphenyl)purine; 8-(3,5-dimethoxyphenyl)-7H-purine-2,6-diamine; 8-(3,5-dimethoxyphenyl)-3h-purine-2,6-diamine
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C13H14N6O2
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| Canonical SMILES |
COC1=CC(=CC(=C1)C2=NC3=NC(=NC(=C3N2)N)N)OC
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| InChI |
1S/C13H14N6O2/c1-20-7-3-6(4-8(5-7)21-2)11-16-9-10(14)17-13(15)19-12(9)18-11/h3-5H,1-2H3,(H5,14,15,16,17,18,19)
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| InChIKey |
CFTYJGDHKCKXBN-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Polypeptide deformylase (PDF) | Target Info | Inhibitor | [1] |
| Pathwhiz Pathway | Folate Metabolism | |||
| Pterine Biosynthesis | ||||
| Reactome | E2F mediated regulation of DNA replication | |||
| Tetrahydrobiopterin (BH4) synthesis, recycling, salvage and regulation | ||||
| Metabolism of folate and pterines | ||||
| G1/S-Specific Transcription | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | CoMFA analysis of tgDHFR and rlDHFR based on antifolates with 6-5 fused ring system using the all-orientation search (AOS) routine and a modified c... Bioorg Med Chem. 2010 Feb 15;18(4):1684-701. | |||
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