Drug Information

Drug General Information
Drug ID
D0U3UM
Former ID
DNC012814
Drug Name
ETONITAZENE
Drug Type
Small molecular drug
Indication Discovery agent Investigative [538998]
Structure
Download
2D MOL

3D MOL
Formula
C22H28N4O3
InChI
InChI=1S/C22H28N4O3/c1-4-24(5-2)13-14-25-21-12-9-18(26(27)28)16-20(21)23-22(25)15-17-7-10-19(11-8-17)29-6-3/h7-12,16H,4-6,13-15H2,1-3H3
InChIKey
PXDBZSCGSQSKST-UHFFFAOYSA-N
CAS Number
CAS 911-65-9
PubChem Compound ID
13493
PubChem Substance ID
6689003, 8160151, 15054622, 29281627, 46508885, 47434902, 48329113, 49882799, 50309062, 57328161, 85209419, 103285455, 103925881, 104331902, 117383265, 126409156, 127331490, 127331491, 127331492, 127331493, 127331494, 128980963, 134224012, 134350019, 134979734, 135650245, 137248664, 144206383, 160964721, 179293665, 198964317, 224204224, 226413319, 241164679, 249950794
Target and Pathway
Target(s) Kappa-type opioid receptor Target Info Inhibitor [531519]
Delta-type opioid receptor Target Info Inhibitor [531519]
Mu-type opioid receptor Target Info Inhibitor [529414]
KEGG Pathway Neuroactive ligand-receptor interactionhsa04022:cGMP-PKG signaling pathway
Sphingolipid signaling pathway
Neuroactive ligand-receptor interactionhsa04080:Neuroactive ligand-receptor interaction
Estrogen signaling pathway
Morphine addiction
NetPath Pathway TCR 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
Opioid prodynorphin pathwayP00026:Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
Enkephalin release
Opioid proenkephalin pathway
Opioid proopiomelanocortin pathwayP00026:Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
Pathway Interaction Database IL4-mediated signaling events
Reactome Peptide ligand-binding receptors
G alpha (i) signalling eventsR-HSA-375276:Peptide ligand-binding receptors
G alpha (i) signalling events
WikiPathways GPCRs, Class A Rhodopsin-like
Peptide GPCRs
GPCR ligand binding
GPCR downstream signalingWP455:GPCRs, Class A Rhodopsin-like
GPCR downstream signalingWP69:TCR Signaling Pathway
Opioid Signalling
GPCR downstream signaling
References
Ref 538998(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: 1624).
Ref 529414Eur J Med Chem. 2008 Nov;43(11):2307-15. Epub 2008 Feb 29.Ligand binding to nucleic acids and proteins: Does selectivity increase with strength?.
Ref 531519J Med Chem. 1990 Sep;33(9):2456-64.Photoactivatable opiate derivatives as irreversible probes of the mu-opioid receptor.

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