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zimeldine 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |
| Stem definition | Drug id | CAS RN |
|---|---|---|
| 2863 | 56775-88-3 |
Description:
| Molecule | Description |
|---|---|
|
Synonyms:
|
One of the SEROTONIN UPTAKE INHIBITORS formerly used for depression but was withdrawn worldwide in September 1983 because of the risk of GUILLAIN-BARRE SYNDROME associated with its use. (From Martindale, The Extra Pharmacopoeia, 29th ed, p385)
|
Drug dosage:
| Dose | Unit | Route |
|---|---|---|
| 0.20 | g | O |
ADMET properties:
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 29 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 6.80 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 13.80 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.09 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 6.26 hours | Lombardo F, Berellini G, Obach RS |
| S (Water solubility) | 50 mg/mL | Bocci G, Oprea TI, Benet LZ |
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Bocci G, Oprea TI, Benet LZ |
Predicted pharmacokinetic/toxicological properties (PK-AZ):
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 2.262 | High | 1 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 0.394 | High | 1 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 45.499 | 10^-6 cm/s | High | 1 |
| dh-clint | Dog hepatocyte intrinsic clearance | 30.409 | uL/min/10^6 cells | High | 1 |
| dppb | Dog plasma protein binding (% unbound) | 34.310 | % | High | 1 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 42.680 | % | High | 1 |
| herg | hERG pIC50 | 5.236 | pIC50 | High | 1 |
| hh-clint | Human hepatocyte intrinsic clearance | 6.095 | uL/min/10^6 cells | High | 1 |
| hlm-clint | Human liver microsomal intrinsic clearance | 15.136 | uL/min/mg protein | High | 1 |
| hppb | Human plasma protein binding (% unbound) | 34.370 | % | High | 1 |
| kinase-safety-class | ACVR2B,AKT1,AKT2,AKT3,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,CHEK1,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPK9,MAPKAPK2,MARK4,MET,NTRK2,PAK4,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TTK | 47 | |||
| kinase-selectivity-class | ACVR2B,AXL,BRAF,EIF2AK3,ERBB2,GRK2 | 6 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 0.474 | High | 1 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 38.726 | High | 1 | |
| mppb | Mouse plasma protein binding (% unbound) | 32.120 | High | 1 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 0.869 | High | 1 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pld-class | Phospholipidosis risk class (1 = positive, 0 = negative) | 1 | High | 1 | |
| pppb | Pig plasma protein binding (% unbound) | 41.230 | % | High | 1 |
| rh-clint | Rat hepatocyte intrinsic clearance | 29.040 | uL/min/10^6 cells | High | 1 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 62.080 | % | High | 1 |
| rppb | Rat plasma protein binding (% unbound) | 26.410 | % | High | 1 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 986.279 | uM | High | 1 |
Approvals:
None
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 | N06AB02 | NERVOUS SYSTEM PSYCHOANALEPTICS ANTIDEPRESSANTS Selective serotonin reuptake inhibitors |
| MeSH PA | D014179 | Neurotransmitter Uptake Inhibitors |
| MeSH PA | D017367 | Selective Serotonin Reuptake Inhibitors |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018490 | Serotonin Agents |
| MeSH PA | D049990 | Membrane Transport Modulators |
| CHEBI has role | CHEBI:35469 | antidepressant |
Related Drugs by ATC class:
N06AB Selective serotonin reuptake inhibitors 7 drugs
Drug Use | Suggest Off label Use Form| |View source of the data|
None
🐶 Veterinary Drug Use
None
🐶 Veterinary products
None
Acid dissociation constants calculated using MoKa v3.0.0
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.67 | Basic |
| pKa2 | 2.95 | 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 |
|---|---|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | GPCR | Ki | 5.73 | PDSP | |||||
| Sodium-dependent serotonin transporter | Transporter | Ki | 6.82 | PDSP | |||||
| Sodium-dependent noradrenaline transporter | Transporter | Ki | 5.03 | PDSP |
External reference:
| ID | Source |
|---|---|
| D06367 | KEGG_DRUG |
| C0043479 | UMLSCUI |
| CHEBI:135357 | CHEBI |
| CHEMBL37744 | ChEMBL_ID |
| DB04832 | DRUGBANK_ID |
| D015031 | MESH_DESCRIPTOR_UI |
| 5365247 | PUBCHEM_CID |
| 4067 | INN_ID |
| 3J928617DW | UNII |
| 96201004 | SNOMEDCT_US |
| CHEMBL1257002 | ChEMBL_ID |
| CHEMBL2355333 | ChEMBL_ID |
Pharmaceutical products:
None