Drug General Information
Drug ID	D0F2ML
Former ID	DNC004594
Drug Name	MEDETOMIDINE
Drug Type	Small molecular drug
Indication	Pain [ICD9: 338, 356.0, 356.8,780; ICD10:G64, G90.0, R52, G89]		Phase 2	[529347]
Structure		Download 2D MOL 3D MOL
Formula	C26H32N4
Canonical SMILES	CC1=C(C(=CC=C1)C(C)C2=CN=CN2)C
InChI	1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)
InChIKey	CUHVIMMYOGQXCV-UHFFFAOYSA-N
CAS Number	CAS 113775-47-6
PubChem Compound ID	73417033
Target and Pathway
Target(s)	Alpha-2A adrenergic receptor	Target Info	Inhibitor	[533805]
	Alpha-1B adrenergic receptor	Target Info	Inhibitor	[533805]
	Alpha-1D adrenergic receptor	Target Info	Inhibitor	[533805]
	Alpha-2B adrenergic receptor	Target Info	Inhibitor	[533805]
	Alpha-1A adrenergic receptor	Target Info	Inhibitor	[533805]
	Alpha-2C adrenergic receptor	Target Info	Inhibitor	[533805]
KEGG Pathway	cGMP-PKG signaling pathway
	Neuroactive ligand-receptor interactionhsa04020:Calcium signaling pathway
	Neuroactive ligand-receptor interaction
	Adrenergic signaling in cardiomyocytes
	Vascular smooth muscle contraction
	Salivary secretionhsa04020:Calcium signaling pathway
	Salivary secretionhsa04022:cGMP-PKG signaling pathway
	AMPK signaling pathway
NetPath Pathway	IL2 Signaling PathwayNetPath_14:IL2 Signaling Pathway
PANTHER Pathway	Alpha adrenergic receptor signaling pathwayP00002:Alpha adrenergic receptor signaling pathwayP00002:Alpha adrenergic receptor signaling pathway
	Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathwayP00002:Alpha adrenergic receptor signaling pathwayP00002:Alpha adrenergic receptor signaling pathway
	Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
Pathway Interaction Database	LPA receptor mediated events
Reactome	Adrenoceptors
	Adrenaline signalling through Alpha-2 adrenergic receptor
	Adrenaline,noradrenaline inhibits insulin secretion
	G alpha (i) signalling events
	G alpha (z) signalling events
	Surfactant metabolismR-HSA-390696:Adrenoceptors
	G alpha (q) signalling events
	G alpha (12/13) signalling eventsR-HSA-390696:Adrenoceptors
	G alpha (z) signalling eventsR-HSA-390696:Adrenoceptors
	Surfactant metabolism
WikiPathways	Monoamine GPCRs
	GPCRs, Class A Rhodopsin-like
	Platelet Aggregation (Plug Formation)
	Integration of energy metabolism
	GPCR ligand binding
	GPCR downstream signalingWP58:Monoamine GPCRs
	Calcium Regulation in the Cardiac Cell
	Vitamin D Receptor Pathway
	Gastrin-CREB signalling pathway via PKC and MAPK
	GPCR downstream signaling
	AMPK SignalingWP58:Monoamine GPCRs
	GPCRs, OtherWP58:Monoamine GPCRs
	Endothelin Pathways
References
Ref 529347	Sedative and cardiopulmonary effects of medetomidine hydrochloride and xylazine hydrochloride and their reversal with atipamezole hydrochloride in calves. Am J Vet Res. 2008 Mar;69(3):319-29.
Ref 533805	J Med Chem. 1994 Jul 22;37(15):2328-33.A structure-activity relationship study of benzylic modifications of 4-[1-(1-naphthyl)ethyl]-1H-imidazoles on alpha 1- and alpha 2-adrenergic receptors.

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