Molecule Details
InChIKeyCPZBLNMUGSZIPR-NVXWUHKLSA-N
Compound NamePalonosetron
Canonical SMILESO=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL9.38
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB00377
Drug NamePalonosetron
CAS Number135729-56-5
Groups approved investigational
ATC Codes A04AA55 A04AA05
DescriptionPalonosetron (INN, trade name Aloxi) is an antagonist of 5-HT3 receptors that is indicated for the prevention and treatment of chemotherapy-induced nausea and vomiting (CINV). It is the most effective of the 5-HT3 antagonists in controlling delayed CINV nausea and vomiting that appear more than 24 h...

Categories: Alimentary Tract and Metabolism Antidepressive Agents Antiemetic Serotonin 5-HT3 Receptor Antagonists Antiemetics Antiemetics and Antinauseants Autonomic Agents Central Nervous System Agents Central Nervous System Depressants Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2D6 Substrates Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Substrates Drugs that are Mainly Renally Excreted Gastrointestinal Agents Heterocyclic Compounds, Fused-Ring Isoquinolines Neurotransmitter Agents Peripheral Nervous System Agents Quinuclidines Serotonergic Drugs Shown to Increase Risk of Serotonin Syndrome Serotonin 3 Receptor Antagonists Serotonin 5-HT3 Receptor Antagonists Serotonin Agents Serotonin Receptor Antagonists
Cross-references: BindingDB: 50417287 ChEBI: 85161 CHEMBL1189679 ChemSpider: 4892289 Drugs Product Database (DPD): 21240 D07175 PDB: O7B PharmGKB: PA10352 PubChem:6337614 PubChem:46508530 RxCUI: 70561 Therapeutic Targets Database: DAP000367 Wikipedia: Palonosetron ZINC: ZINC000003795819
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
O95264 HTR3B Homo sapiens Human PF02931 PF02932 9.6 Kd ChEMBL
P46098 HTR3A Homo sapiens Human PF02931 PF02932 9.1 IC50 ChEMBL;BindingDB
DrugBank Target Actions (4)
Target Gene Target Name Action Type
P05177 CYP1A2 Cytochrome P450 1A2 substrate enzymes
P08684 CYP3A4 Cytochrome P450 3A4 substrate enzymes
P10635 CYP2D6 Cytochrome P450 2D6 substrate enzymes
P46098 HTR3A 5-hydroxytryptamine receptor 3A antagonist targets