New Release: Alpha testing version has been released.

Agomelatine

N06A - Antidepressants ATC N06AX22 Small molecule approved 2009 Oral Natural product

JFDA label: Valdoxan

Mechanism of Action

Agonist of Melatonin receptor — Melatonin receptor agonist; Antagonist of 5-hydroxytryptamine receptor 2C — Serotonin 2c (5-HT2c) receptor antagonist

TargetActionGene / class
5-hydroxytryptamine receptor 2C efficacy ANTAGONIST HTR2C
Melatonin receptor efficacy AGONIST

Indications

Approved

  • Depressive Disorder — depressive disorder
  • Depressive Disorder, Major — major depressive disorder

Off-label

  • Anxiety
  • Dementia
  • Obsessive-Compulsive Disorder
  • Schizophrenia

Adverse Reactions

Very Common >10%Common 1–10%Uncommon 0.1–1% Rare 0.01–0.1%Very Rare <0.01%Not Known

Nervous system disorders (1)

Uncommon Paraesthesia

Hepatobiliary disorders (1)

Rare Hepatitis

Skin and subcutaneous tissue disorders (4)

Uncommon Eczema · Pruritus · Urticaria

Rare Rash erythematous

Eye disorders (1)

Uncommon Vision blurred

Pregnancy & Lactation

Lactation

Caution Hale L3

A minimal amount of information indicates that exposure and adverse effects can be avoided in breastfed infants if breastfeeding is held for 4 hours after a dose.

Chemistry & Properties

2D structure
FormulaC15H17NO2
Molecular weight243.31 g/mol
IUPAC nameN-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CAS138112-76-2
PubChem CID82148
InChIKeyYJYPHIXNFHFHND-UHFFFAOYSA-N
logP2.53 (XLogP 2.7)
Polar surface area38.33 Ų
H-bond acceptors / donors2 / 1
Drug-likeness (QED)0.90
Lipinski violations0
SMILESCOc1ccc2cccc(CCNC(C)=O)c2c1

Biology & Pharmacokinetics

Pharmacokinetics predicted

Bioavailability70.0%
Half-life0.688 h
Volume of distribution0.699 L/kg
Protein binding87.6%
BBB penetrantNo

Enzyme interactions

EnzymeRoleDetail
CYP1A2Inhibitor
CYP1A2Substrate
CYP2C19Inhibitor
CYP2C19Substrate
CYP2C8Inhibitor
CYP2C9Substrate
CYP2D6Substrate
CYP3A4Inhibitor

Receptor binding (top 3)

TargetActionAffinity
5-HT2B receptor (HTR2B) Antagonist pKi 6.6
5-HT2C receptor (HTR2C) Antagonist pKi 6.2
5-HT2A receptor (HTR2A) Antagonist pKi 5.4

Transporters

BCRP (Inhibitor)BSEP (Inhibitor)BSEP (Inhibitor)MRP1 (Inhibitor)MRP2 (Inhibitor)MRP3 (Inhibitor)MRP4 (Inhibitor)OATP1B1 (Inhibitor)OATP1B3 (Inhibitor)P-gp (Inhibitor)MDR1 (Substrate)P-gp (Substrate)

Registered Products (1)

BrandForm / strengthPackAgentCitizen (JOD)
Valdoxan Tablet 25 mg 28 tab The Jordan Drugstore Co 24.080