Molecule Details
| InChIKey | OJLOPKGSLYJEMD-URPKTTJQSA-N |
|---|---|
| Compound Name | Misoprostol |
| Canonical SMILES | CCCCC(C)(O)C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.74 |
| Source | BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB00929 |
|---|---|
| Drug Name | Misoprostol |
| CAS Number | 59122-46-2 |
| Groups | approved investigational |
| ATC Codes | G02AD06 A02BB01 M01AE56 |
| Description | Misoprostol is a prostaglandin analog used to reduce the risk of NSAID related ulcers, manage miscarriages, prevent post partum hemorrhage, and also for first trimester abortions.[L7616,L7619,A181589,A181583,A181697] The stimulation of prostaglandin receptors in the stomach reduces gastric acid secr... |
Categories: Abortifacient Agents Abortifacient Agents, Nonsteroidal Alimentary Tract and Metabolism Anti-Ulcer Agents Antiinflammatory and Antirheumatic Products Antiinflammatory and Antirheumatic Products, Non-Steroids Autacoids Biological Factors Drugs causing inadvertant photosensitivity Drugs for Acid Related Disorders Drugs for Peptic Ulcer and Gastro-Oesophageal Reflux Disease (Gord) Eicosanoids Fatty Acids Fatty Acids, Unsaturated Gastrointestinal Agents Genito Urinary System and Sex Hormones Inflammation Mediators Lipids Musculo-Skeletal System Photosensitizing Agents Propionates Prostaglandin E1 Analog Prostaglandins Prostaglandins E, Synthetic Prostaglandins, Synthetic Reproductive Control Agents Uterotonic agents
Cross-references: BindingDB: 85606 ChEBI: 63610 CHEMBL606 ChemSpider: 4445541 Drugs Product Database (DPD): 1859 D00419 PharmGKB: PA450523 PubChem:5282381 PubChem:46505041 RxCUI: 42331 Therapeutic Targets Database: DAP000358 Wikipedia: Misoprostol
Target Activities (3)
DrugBank Target Actions (5)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P34995 | PTGER1 | Prostaglandin E2 receptor EP1 subtype | agonist | targets |
| P35408 | PTGER4 | Prostaglandin E2 receptor EP4 subtype | agonist | targets |
| P43115 | PTGER3 | Prostaglandin E2 receptor EP3 subtype | agonist | targets |
| P43116 | PTGER2 | Prostaglandin E2 receptor EP2 subtype | agonist | targets |
| P43119 | PTGIR | Prostacyclin receptor | antagonist | targets |