Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D06YJN
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| Former ID |
DNC011890
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| Drug Name |
1,3-Diallyl-7-methyl-3,7-dihydro-purine-2,6-dione
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| Synonyms |
CHEMBL26406; 1,3-diallyl-7-methylxanthine; 1,3-Diallyl-7-methyl-3,7-dihydro-purine-2,6-dione; BDBM50025574; 1,3-Di(2-propenyl)-7-methylxanthine
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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 |
C12H14N4O2
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| Canonical SMILES |
CN1C=NC2=C1C(=O)N(C(=O)N2CC=C)CC=C
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| InChI |
1S/C12H14N4O2/c1-4-6-15-10-9(14(3)8-13-10)11(17)16(7-5-2)12(15)18/h4-5,8H,1-2,6-7H2,3H3
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| InChIKey |
YAUBCZNTZIWFJS-UHFFFAOYSA-N
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| CAS Number |
CAS 102284-65-1
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Adenosine A2a receptor (ADORA2A) | Target Info | Inhibitor | [1] |
| KEGG Pathway | Rap1 signaling pathway | |||
| Calcium signaling pathway | ||||
| cAMP signaling pathway | ||||
| Neuroactive ligand-receptor interaction | ||||
| Vascular smooth muscle contraction | ||||
| Parkinson's disease | ||||
| Alcoholism | ||||
| Pathwhiz Pathway | Intracellular Signalling Through Adenosine Receptor A2a and Adenosine | |||
| Pathway Interaction Database | HIF-2-alpha transcription factor network | |||
| Reactome | NGF-independant TRKA activation | |||
| Adenosine P1 receptors | ||||
| G alpha (s) signalling events | ||||
| Surfactant metabolism | ||||
| WikiPathways | Nucleotide GPCRs | |||
| Monoamine Transport | ||||
| GPCRs, Class A Rhodopsin-like | ||||
| NGF signalling via TRKA from the plasma membrane | ||||
| GPCR ligand binding | ||||
| GPCR downstream signaling | ||||
| GPCRs, Other | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Analogues of caffeine and theophylline: effect of structural alterations on affinity at adenosine receptors. J Med Chem. 1986 Jul;29(7):1305-8. | |||
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