POY

3-methyl-1-(5-oxohexyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione

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is present as a standalone ligand in 2 entries

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Chemical Component Summary
Name	3-methyl-1-(5-oxohexyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Synonyms	Propentofylline
Identifiers	3-methyl-1-(5-oxohexyl)-7-propyl-purine-2,6-dione
Formula	C₁₅ H₂₂ N₄ O₃
Molecular Weight	306.36
Type	NON-POLYMER
Isomeric SMILES	CCCn1cnc2c1C(=O)N(C(=O)N2C)CCCCC(=O)C
InChI	InChI=1S/C15H22N4O3/c1-4-8-18-10-16-13-12(18)14(21)19(15(22)17(13)3)9-6-5-7-11(2)20/h10H,4-9H2,1-3H3
InChIKey	RBQOQRRFDPXAGN-UHFFFAOYSA-N

Chemical Details
Formal Charge	0
Atom Count	44
Chiral Atom Count	0
Bond Count	45
Aromatic Bond Count	5

Drug Info: DrugBank

DrugBank ID	DB06479
Name	Propentofylline
Groups	investigational
Synonyms	Propentofylline
Indication	Investigated for use/treatment in alzheimer's disease.
Categories	Alkaloids Anti-Ulcer Agents Central Nervous System Agents Compounds used in a research, industrial, or household setting Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 Substrates Heterocyclic Compounds, Fused-Ring Nervous System Neuroprotective Agents Protective Agents Psychoanaleptics Psychostimulants, Agents Used for ADHD and Nootropics Purines Purinones Xanthine derivatives
ATC-Code	N06BC02
CAS number	55242-55-2

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
cAMP-specific 3',5'-cyclic phosphodiesterase 4A	MEPPTVPSERSLSLSLPGPREGQATLKPPPQHLWRQPRTPIRIQQRGYSD...	unknown
Cytochrome P450 1A2	MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPL...	unknown	substrate

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682