Molecule Details
| InChIKey | IUBSYMUCCVWXPE-UHFFFAOYSA-N |
|---|---|
| Compound Name | Metoprolol |
| Canonical SMILES | COCCc1ccc(OCC(O)CNC(C)C)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.07 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB00264 |
|---|---|
| Drug Name | Metoprolol |
| CAS Number | 51384-51-1 |
| Groups | approved investigational |
| ATC Codes | C07FB02 C07FX05 C07FX03 C07FB13 C07AB02 C07BB52 C07CB02 C07BB02 |
| Description | Metoprolol is a selective beta-1 blocker commonly employed as the succinate and tartrate derivatives depending if the formulation is designed to be of immediate release or extended release.[A175159, L5530] The possibility of the generation of these formulations comes from the lower systemic bioavail... |
Categories: Adrenergic Agents Adrenergic Antagonists Adrenergic beta-1 Receptor Antagonists Adrenergic beta-Antagonists Agents causing hyperkalemia Alcohols Amines Amino Alcohols Antiarrhythmic agents Antihypertensive Agents Antihypertensive Agents Indicated for Hypertension Beta Blocking Agents and Thiazides Beta Blocking Agents, Selective Beta Blocking Agents, Selective, and Thiazides Beta blocking agents and calcium channel blockers Beta-Blockers (Beta1 Selective) Bradycardia-Causing Agents Cardiovascular Agents Cytochrome P-450 CYP2D6 Inhibitors Cytochrome P-450 CYP2D6 Inhibitors (moderate) Cytochrome P-450 CYP2D6 Substrates Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A4 Substrates (strength unknown) Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Drugs causing inadvertant photosensitivity Drugs that are Mainly Renally Excreted Hypotensive Agents OCT2 Inhibitors Photosensitizing Agents Propanolamines
Cross-references: BindingDB: 25756 ChEBI: 6904 CHEMBL13 ChemSpider: 4027 Drugs Product Database (DPD): 2167 Guide to Pharmacology: 553 IUPHAR: 553 C07202 D02358 PharmGKB: PA450480 PubChem:4171 PubChem:46506211 RxCUI: 6918 Therapeutic Targets Database: DAP000481 Wikipedia: Metoprolol
Target Activities (2)
DrugBank Target Actions (8)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P02768 | ALB | Albumin | binder | carriers |
| P10635 | CYP2D6 | Cytochrome P450 2D6 | inhibitor | enzymes |
| P08684 | CYP3A4 | Cytochrome P450 3A4 | substrate | enzymes |
| P10635 | CYP2D6 | Cytochrome P450 2D6 | substrate | enzymes |
| P07550 | ADRB2 | Beta-2 adrenergic receptor | antagonist | targets |
| P08588 | ADRB1 | Beta-1 adrenergic receptor | antagonist | targets |
| P08588 | ADRB1 | Beta adrenergic receptor | inhibitor | targets |
| O15244 | SLC22A2 | Solute carrier family 22 member 2 | inhibitor | transporters |