Molecule Details
| InChIKey | PXGPLTODNUVGFL-YNNPMVKQSA-N |
|---|---|
| Compound Name | Dinoprost |
| Canonical SMILES | CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@H]1O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.26 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB12789 |
|---|---|
| Drug Name | Dinoprost |
| CAS Number | 551-11-1 |
| Groups | approved withdrawn |
| ATC Codes | G02AD01 |
| Description | Dinoprost has been investigated in Headache. |
Categories: Abortifacient Agents Abortifacient Agents, Nonsteroidal Autacoids Biological Factors Eicosanoids Fatty Acids Fatty Acids, Unsaturated Genito Urinary System and Sex Hormones Inflammation Mediators Lipids Prostaglandins Prostaglandins F Reproductive Control Agents Uterotonic agents
Cross-references: BindingDB: 50035622 ChEBI: 15553 CHEMBL815 ChemSpider: 4444062 Drugs Product Database (DPD): 11487 C00639 PDB: UGU PubChem:5280363 PubChem:347828968 RxCUI: 3477 Wikipedia: Prostaglandin_F2alpha ZINC: ZINC000003830709
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P43088 | PTGFR | Homo sapiens | Human | PF00001 | 8.2 | IC50 | ChEMBL;BindingDB |
| Q92959 | SLCO2A1 | Homo sapiens | Human | PF07648 PF03137 | 7.6 | Ki | ChEMBL;BindingDB |
| P43115 | PTGER3 | Homo sapiens | Human | PF00001 | 6.7 | IC50 | ChEMBL;BindingDB |
| P34995 | PTGER1 | Homo sapiens | Human | PF00001 | 6.5 | IC50 | ChEMBL;BindingDB |
DrugBank Target Actions (8)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P21731 | TBXA2R | Thromboxane A2 receptor | agonist | targets |
| P34995 | PTGER1 | Prostaglandin E2 receptor EP1 subtype | agonist | targets |
| P35408 | PTGER4 | Prostaglandin E2 receptor EP4 subtype | agonist | targets |
| P43088 | PTGFR | Prostaglandin F2-alpha receptor | agonist | targets |
| P43115 | PTGER3 | Prostaglandin E2 receptor EP3 subtype | agonist | targets |
| P43116 | PTGER2 | Prostaglandin E2 receptor EP2 subtype | agonist | targets |
| Q13258 | PTGDR | Prostaglandin D2 receptor | agonist | targets |
| Q9Y5Y4 | PTGDR2 | Prostaglandin D2 receptor 2 | agonist | targets |