Drug Information
Drug General Information | Top | |||
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Drug ID |
D0E6ON
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Former ID |
DNC012170
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Drug Name |
3-(6-Amino-purin-9-yl)-5-m-tolyl-pentan-2-ol
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Synonyms |
CHEMBL418074; 3-(6-Amino-purin-9-yl)-5-m-tolyl-pentan-2-ol; SCHEMBL7455950; ZINC13835543; BDBM50070643; (2S,3R)-3-(6-Amino-purin-9-yl)-5-m-tolyl-pentan-2-ol
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Drug Type |
Small molecular drug
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Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
Structure |
Download2D MOL |
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Formula |
C17H21N5O
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Canonical SMILES |
CC1=CC(=CC=C1)CCC(C(C)O)N2C=NC3=C(N=CN=C32)N
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InChI |
1S/C17H21N5O/c1-11-4-3-5-13(8-11)6-7-14(12(2)23)22-10-21-15-16(18)19-9-20-17(15)22/h3-5,8-10,12,14,23H,6-7H2,1-2H3,(H2,18,19,20)/t12-,14+/m0/s1
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InChIKey |
VVISVMDMFZVYMH-GXTWGEPZSA-N
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PubChem Compound ID |
Target and Pathway | Top | |||
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Target(s) | Adenosine deaminase (ADA) | Target Info | Inhibitor | [1] |
BioCyc | Purine nucleotides degradation | |||
Purine deoxyribonucleosides degradation | ||||
Purine ribonucleosides degradation to ribose-1-phosphate | ||||
Adenosine nucleotides degradation | ||||
Superpathway of purine nucleotide salvage | ||||
Adenine and adenosine salvage III | ||||
KEGG Pathway | Purine metabolism | |||
Metabolic pathways | ||||
Primary immunodeficiency | ||||
NetPath Pathway | TCR Signaling Pathway | |||
IL2 Signaling Pathway | ||||
Panther Pathway | Adenine and hypoxanthine salvage pathway | |||
Pathwhiz Pathway | Purine Metabolism | |||
Pathway Interaction Database | p73 transcription factor network | |||
C-MYB transcription factor network | ||||
Validated transcriptional targets of deltaNp63 isoforms | ||||
Validated transcriptional targets of TAp63 isoforms | ||||
Reactome | Purine salvage | |||
WikiPathways | Metabolism of nucleotides |
References | Top | |||
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REF 1 | Adenosine deaminase inhibitors: synthesis and biological evaluation of unsaturated, aromatic, and oxo derivatives of (+)-erythro-9-(2'S-hydroxy-3'R... J Med Chem. 2000 Nov 30;43(24):4694-700. |
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