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reboxetine 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |
| Stem definition | Drug id | CAS RN |
|---|---|---|
| serotonin and/or norepinephrine reuptake inhibitors, fluoxetine derivatives | 2361 | 71620-89-8 |
Description:
| Molecule | Description |
|---|---|
|
Synonyms:
|
A morpholine derivative that is a selective and potent noradrenaline reuptake inhibitor; it is used in the treatment of DEPRESSIVE DISORDER.
|
Drug dosage:
| Dose | Unit | Route |
|---|---|---|
| 8 | mg | O |
ADMET properties:
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Benet LZ, Broccatelli F, Oprea TI |
| S (Water solubility) | 8 mg/mL | Benet LZ, Broccatelli F, Oprea TI |
| EoM (Fraction excreted unchanged in urine) | 10 % | Benet LZ, Broccatelli F, Oprea TI |
| MRTD (Maximum Recommended Therapeutic Daily Dose) | 0.55 µM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
| BA (Bioavailability) | 94 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 0.65 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 0.82 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.02 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 10 hours | Lombardo F, Berellini G, Obach RS |
Predicted pharmacokinetic/toxicological properties (PK-AZ):
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 1.917 | Moderate | 0.77 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 3.258 | Moderate | 0.77 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 26.363 | 10^-6 cm/s | Moderate | 0.77 |
| dh-clint | Dog hepatocyte intrinsic clearance | 19.320 | uL/min/10^6 cells | Moderate | 0.77 |
| dppb | Dog plasma protein binding (% unbound) | 16.730 | % | Moderate | 0.77 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 21.590 | % | Moderate | 0.77 |
| herg | hERG pIC50 | 5.221 | pIC50 | Moderate | 0.77 |
| hh-clint | Human hepatocyte intrinsic clearance | 3.475 | uL/min/10^6 cells | Moderate | 0.77 |
| hlm-clint | Human liver microsomal intrinsic clearance | 12.388 | uL/min/mg protein | Moderate | 0.77 |
| hppb | Human plasma protein binding (% unbound) | 18.360 | % | Moderate | 0.77 |
| kinase-safety-class | ACVR2B,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,EIF2AK3,EPHB4,ERBB2,GRK2,ITK,MAPK7,NTRK2,PDK2,PDK4,PRKDC,TEK,TGFBR1 | 19 | |||
| kinase-selectivity-class | AXL,GRK2,PDK4 | 3 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.547 | Moderate | 0.77 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 81.096 | Moderate | 0.77 | |
| mppb | Mouse plasma protein binding (% unbound) | 16.790 | Moderate | 0.77 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 6.776 | Moderate | 0.77 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 33.230 | % | Moderate | 0.77 |
| rh-clint | Rat hepatocyte intrinsic clearance | 138.995 | uL/min/10^6 cells | Moderate | 0.77 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 53.510 | % | Moderate | 0.77 |
| rppb | Rat plasma protein binding (% unbound) | 19.200 | % | Moderate | 0.77 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 903.649 | uM | Moderate | 0.77 |
Approvals:
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Jan. 1, 1997 | YEAR INTRODUCED |
FDA Adverse Event Reporting System (Female)
None
FDA Adverse Event Reporting System (Male)
None
FDA Adverse Event Reporting System (Geriatric)
None
FDA Adverse Event Reporting System (Pediatric)
None
Pharmacologic Action:
| Source | Code | Description |
|---|---|---|
| ATC | N06AX18 | NERVOUS SYSTEM PSYCHOANALEPTICS ANTIDEPRESSANTS Other antidepressants |
| MeSH PA | D000928 | Antidepressive Agents |
| MeSH PA | D011619 | Psychotropic Drugs |
| MeSH PA | D014179 | Neurotransmitter Uptake Inhibitors |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018663 | Adrenergic Agents |
| MeSH PA | D018759 | Adrenergic Uptake Inhibitors |
| MeSH PA | D049990 | Membrane Transport Modulators |
| CHEBI has role | CHEBI:35469 | antidepressant |
| CHEBI has role | CHEBI:35474 | anxiolytic drug |
| CHEBI has role | CHEBI:35476 | antipsychotic agent |
| CHEBI has role | CHEBI:35480 | analgesic |
Related Drugs by ATC class:
N06AX Other antidepressants 28 drugs
Drug Use | Suggest Off label Use Form| |View source of the data|
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Major depressive disorder | indication | 370143000 |
🐶 Veterinary Drug Use
None
🐶 Veterinary products
None
Acid dissociation constants calculated using MoKa v3.0.0
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.44 | Basic |
Orange Book patent data (new drug applications)
None
Orange Book exclusivity data (new drug applications)
None
Bioactivity Summary:
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Sodium-dependent serotonin transporter | Transporter | Ki | 8.05 | CHEMBL | |||||
| Sodium-dependent noradrenaline transporter | Transporter | Ki | 8.96 | CHEMBL | |||||
| 5-hydroxytryptamine receptor 2C | GPCR | Ki | 6.34 | PDSP | |||||
| 5-hydroxytryptamine receptor 6 | GPCR | Ki | 6.34 | WOMBAT-PK | |||||
| Sodium-dependent dopamine transporter | Transporter | Ki | 7.22 | CHEMBL | |||||
| G protein-activated inward rectifier potassium channel 2 | Ion channel | IC50 | 4.19 | WOMBAT-PK | |||||
| Kir3.1/Kir3.2 | Ion channel | IC50 | 4.32 | WOMBAT-PK | |||||
| Kir3.1/Kir3.4 | Ion channel | IC50 | 4.39 | WOMBAT-PK | |||||
| Sodium-dependent serotonin transporter | Transporter | Ki | 6.30 | CHEMBL | |||||
| Transporter | Transporter | Ki | 7.86 | CHEMBL | |||||
| Transporter | Transporter | Ki | 9.16 | CHEMBL |
External reference:
| ID | Source |
|---|---|
| 4025264 | VUID |
| N0000171792 | NUI |
| D02573 | KEGG_DRUG |
| 98769-84-7 | SECONDARY_CAS_RN |
| 4025263 | VANDF |
| 4025264 | VANDF |
| C0168388 | UMLSCUI |
| CHEBI:135342 | CHEBI |
| 41X | PDB_CHEM_ID |
| CHEMBL180101 | ChEMBL_ID |
| CHEMBL14370 | ChEMBL_ID |
| CHEMBL2146087 | ChEMBL_ID |
| DB00234 | DRUGBANK_ID |
| D000077593 | MESH_DESCRIPTOR_UI |
| 127151 | PUBCHEM_CID |
| 4808 | IUPHAR_LIGAND_ID |
| 5858 | INN_ID |
| 947S0YZ36I | UNII |
| 153494 | RXNORM |
| 006792 | NDDF |
| 321995004 | SNOMEDCT_US |
| 395859006 | SNOMEDCT_US |
| 783568009 | SNOMEDCT_US |
Pharmaceutical products:
None