Drug Information

Drug General Information
Drug ID
D0X0IY
Former ID
DCL000965
Drug Name
Rolofylline
Synonyms
KW 3902; HMR-4902; KW-3902; MK-7418; Rolofylline (USAN); 1,3-Dipropyl-8-(3-noradamantyl)xanthine; 1,3-Dnax; 8-(3-Noradamantyl)-1,3-dipropylxanthine; 8-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)-3,7-dihydro-1,3-dipropyl-1H-purine-2,6-dione; 8-(Noradamantan-3-yl)-1,3-dipropylxanthine; 8-(hexahydro-2,5-methanopentalen-3a(1h)-yl)-1,3-dipropyl-3,7-dihydro-1h-purine-2,6-dione
Drug Type
Small molecular drug
Indication Heart failure [ICD9: 428; ICD10:I50] Phase 3 [537064], [540972]
Company
Merck
Structure
Download
2D MOL

3D MOL
Formula
C20H28N4O2
InChI
InChI=1S/C20H28N4O2/c1-3-5-23-16-15(17(25)24(6-4-2)19(23)26)21-18(22-16)20-10-12-7-13(11-20)9-14(20)8-12/h12-14H,3-11H2,1-2H3,(H,21,22)
InChIKey
PJBFVWGQFLYWCB-UHFFFAOYSA-N
CAS Number
CAS 136199-02-5
PubChem Compound ID
64627
PubChem Substance ID
8189215, 12014585, 14828063, 43121521, 50027933, 57315094, 75918570, 85210038, 96025672, 103234175, 103917051, 104331610, 117600080, 125823156, 128923271, 134224383, 134339133, 134339318, 134339401, 135022015, 137124824, 139358810, 160676374, 175426983, 178102238, 179149860, 227009357, 238445391, 241033164, 241376845, 249618094, 252157840, 252160290
Target and Pathway
Target(s) Adenosine A1 receptor Target Info Antagonist [537064]
KEGG Pathway cGMP-PKG signaling pathway
cAMP signaling pathway
Sphingolipid signaling pathway
Neuroactive ligand-receptor interaction
Morphine addiction
NetPath Pathway TCR Signaling Pathway
RANKL Signaling Pathway
PANTHER Pathway Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
Heterotrimeric G-protein signaling pathway-Gq alpha and Go alpha mediated pathway
Reactome Adenosine P1 receptors
G alpha (i) signalling events
WikiPathways Nucleotide GPCRs
GPCRs, Class A Rhodopsin-like
GPCR ligand binding
GPCR downstream signaling
References
Ref 537064Association between the PDE4D gene and ischemic stroke in Han Chinese population. Clin Sci (Lond). 2009 Feb 5.
Ref 540972(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5604).
Ref 537064Association between the PDE4D gene and ischemic stroke in Han Chinese population. Clin Sci (Lond). 2009 Feb 5.

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