Molecule Details
InChIKeyYQEZLKZALYSWHR-ZDUSSCGKSA-N
Compound NameEsketamine
Canonical SMILESCN[C@]1(c2ccccc2Cl)CCCCC1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL7.94
SourceChEMBL
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB11823
Drug NameEsketamine
CAS Number33643-46-8
Groups approved investigational
ATC Codes N06AX27 N01AX14
DescriptionMajor depressive disorder (MDD) is a significant cause of disability worldwide and the most common illness preceding suicide.[L5596,A175462] On March 5, 2019, the nasal spray drug, _esketamine_, also known as _Spravato_ (by Janssen Pharmaceuticals), was approved by the FDA for treatment-resistant ma...

Categories: Agents producing tachycardia Anesthetics Anesthetics, General Antidepressive Agents Antidepressive Agents Indicated for Depression Central Nervous System Agents Central Nervous System Depressants Cyclohexanes Cycloparaffins Cytochrome P-450 CYP2B6 Inducers Cytochrome P-450 CYP2B6 Inducers (weak) Cytochrome P-450 CYP2B6 Substrates Cytochrome P-450 CYP2C19 Substrates Cytochrome P-450 CYP2C9 Substrates Cytochrome P-450 CYP3A Inducers Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inducers Cytochrome P-450 CYP3A4 Inducers (weak) Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Substrates Miscellaneous Antidepressants NMDA Receptor Antagonists Nervous System Non-Competitive N-Methyl D-Aspartate (NMDA) Receptor Antagonists Psychoanaleptics Psychotropic Drugs
Cross-references: ChEBI: 60799 CHEMBL395091 ChemSpider: 158414 Drugs Product Database (DPD): 23459 D07283 PDB: JC9 PubChem:182137 PubChem:347828170 RxCUI: 2119365 Wikipedia: Esketamine ZINC: ZINC000035999642
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
Q05586 GRIN1 Homo sapiens Human PF01094 PF00060 PF10613 7.9 IC50 ChEMBL
Q12879 GRIN2A Homo sapiens Human PF01094 PF00060 PF10613 PF10565 7.9 IC50 ChEMBL
DrugBank Target Actions (11)
Target Gene Target Name Action Type
P08684 CYP3A4 Cytochrome P450 3A4 inducer enzymes
P20813 CYP2B6 Cytochrome P450 2B6 inducer enzymes
P08684 CYP3A4 Cytochrome P450 3A4 substrate enzymes
P11712 CYP2C9 Cytochrome P450 2C9 substrate enzymes
P20813 CYP2B6 Cytochrome P450 2B6 substrate enzymes
P33261 CYP2C19 Cytochrome P450 2C19 substrate enzymes
P23560 P23560 Neurotrophic factor BDNF precursor form agonist targets
Q05586 GRIN1 NMDA receptor antagonist targets
Q13224 GRIN2B Glutamate receptor ionotropic, NMDA 2B antagonist targets
P13639 P13639 Elongation factor 2 inhibitor targets
Q16620 NTRK2 BDNF/NT-3 growth factors receptor upregulator targets