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clenbuterol 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |
| Stem definition | Drug id | CAS RN |
|---|---|---|
| bronchodilators, phenethylamine derivatives | 673 | 37148-27-9 |
Description:
| Molecule | Description |
|---|---|
|
Synonyms:
|
A substituted phenylaminoethanol that has beta-2 adrenomimetic properties at very low doses. It is used as a bronchodilator in asthma.
|
Drug dosage:
| Dose | Unit | Route |
|---|---|---|
| 40 | mcg | O |
ADMET properties:
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 99 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| S (Water solubility) | 4 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 | 0.578 | Moderate | 0.67 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 1.419 | Moderate | 0.67 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 9.954 | 10^-6 cm/s | Moderate | 0.67 |
| dh-clint | Dog hepatocyte intrinsic clearance | 3.954 | uL/min/10^6 cells | Moderate | 0.67 |
| dppb | Dog plasma protein binding (% unbound) | 65.060 | % | Moderate | 0.67 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 66.670 | % | Moderate | 0.67 |
| herg | hERG pIC50 | 4.430 | pIC50 | Moderate | 0.67 |
| hh-clint | Human hepatocyte intrinsic clearance | 2.249 | uL/min/10^6 cells | Moderate | 0.67 |
| hlm-clint | Human liver microsomal intrinsic clearance | 3.436 | uL/min/mg protein | Moderate | 0.67 |
| hppb | Human plasma protein binding (% unbound) | 66.250 | % | Moderate | 0.67 |
| kinase-safety-class | ACVR2A,ACVR2B,AKT1,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MET,NTRK2,PDK1,PDK2,PDK4,PIK3CB,PIK3CG,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,ZAP70 | 49 | |||
| kinase-selectivity-class | AXL,EIF2AK3,GRK2,PDK4 | 4 | |||
| mdck-mdr1-bcrp-efflux | MDCK-MDR1-BCRP efflux ratio | 3.475 | Moderate | 0.67 | |
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.254 | Moderate | 0.67 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 27.733 | Moderate | 0.67 | |
| mppb | Mouse plasma protein binding (% unbound) | 66.510 | Moderate | 0.67 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 3.027 | Moderate | 0.67 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 70.860 | % | Moderate | 0.67 |
| rat-kpuu-brain | Rat brain Kpuu | 0.093 | % | Moderate | 0.67 |
| rh-clint | Rat hepatocyte intrinsic clearance | 28.314 | uL/min/10^6 cells | Moderate | 0.67 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 83.560 | % | Moderate | 0.67 |
| rppb | Rat plasma protein binding (% unbound) | 66 | % | Moderate | 0.67 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 901.571 | uM | Moderate | 0.67 |
Approvals:
| Date | Agency | Company | Orphan |
|---|---|---|---|
| None | FDA |
FDA Adverse Event Reporting System (Female)
None
FDA Adverse Event Reporting System (Male)
None
FDA Adverse Event Reporting System (Geriatric)
| MedDRA adverse event term | Likelihood ratio | Likelihood ratio threshold | Patients taking drug having adverse event | Patients taking drug not having adverse event | Patients not taking drug having adverse event | Patients not taking drug not having adverse event |
|---|---|---|---|---|---|---|
| Intentional product misuse | 88.25 | 63.58 | 31 | 547 | 132873 | 110455848 |
| Hyperthyroidism | 73.09 | 63.58 | 19 | 559 | 29242 | 110559479 |
| Myocarditis | 67.78 | 63.58 | 18 | 560 | 30037 | 110558684 |
FDA Adverse Event Reporting System (Pediatric)
None
Pharmacologic Action:
| Source | Code | Description |
|---|---|---|
| ATC | R03AC14 | RESPIRATORY SYSTEM DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES ADRENERGICS, INHALANTS Selective beta-2-adrenoreceptor agonists |
| ATC | R03CC13 | RESPIRATORY SYSTEM DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES ADRENERGICS FOR SYSTEMIC USE Selective beta-2-adrenoreceptor agonists |
| ATC | R03CC63 | RESPIRATORY SYSTEM DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES ADRENERGICS FOR SYSTEMIC USE Selective beta-2-adrenoreceptor agonists |
| MeSH PA | D000318 | Adrenergic beta-Agonists |
| MeSH PA | D001993 | Bronchodilator Agents |
| MeSH PA | D013566 | Sympathomimetics |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018663 | Adrenergic Agents |
| MeSH PA | D018927 | Anti-Asthmatic Agents |
| MeSH PA | D019141 | Respiratory System Agents |
| CHEBI has role | CHEBI:35522 | β-adrenergic agonist |
| CHEBI has role | CHEBI:35523 | bronchodilator agent |
| CHEBI has role | CHEBI:35524 | sympathomimetic agent |
| CHEBI has role | CHEBI:35526 | hypoglycemic agent |
| CHEBI has role | CHEBI:48407 | antiparkinson drug |
Related Drugs by ATC class:
R03AC Selective beta-2-adrenoreceptor agonists 17 drugs
R03CC Selective beta-2-adrenoreceptor agonists 14 drugs
Drug Use | Suggest Off label Use Form| |View source of the data|
None
🐶 Veterinary Drug Use
| Species | Use | Relation |
|---|---|---|
| Horses | Management of horses affected with airway obstruction | Indication |
🐶 Veterinary products
| Product | Applicant | Ingredients |
|---|---|---|
| Ventipulmin Syrup | Boehringer lngelheim Animal Health USA Inc. | 1 |
Acid dissociation constants calculated using MoKa v3.0.0
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.08 | Basic |
| pKa2 | 1.84 | 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 |
|---|---|---|---|---|---|---|---|---|---|
| Beta-1 adrenergic receptor | GPCR | Ki | 7.16 | DRUG MATRIX | |||||
| Beta-2 adrenergic receptor | GPCR | Kd | 7.80 | CHEMBL | |||||
| 5-hydroxytryptamine receptor 1A | GPCR | Ki | 5.82 | DRUG MATRIX | |||||
| 5-hydroxytryptamine receptor 1A | GPCR | IC50 | 5.58 | CHEMBL | |||||
| Beta-2 adrenergic receptor | GPCR | Kd | 7.44 | CHEMBL |
External reference:
| ID | Source |
|---|---|
| N0000166810 | NUI |
| D01360 | KEGG_DRUG |
| 235955 | RXNORM |
| C0008932 | UMLSCUI |
| CHEBI:174690 | CHEBI |
| CHEMBL49080 | ChEMBL_ID |
| DB01407 | DRUGBANK_ID |
| CHEMBL1330729 | ChEMBL_ID |
| D002976 | MESH_DESCRIPTOR_UI |
| 2783 | PUBCHEM_CID |
| 12582 | IUPHAR_LIGAND_ID |
| 3264 | INN_ID |
| 21898-19-1 | SECONDARY_CAS_RN |
| XTZ6AXU7KN | UNII |
| 004338 | NDDF |
| 004339 | NDDF |
| 1000821000202102 | SNOMEDCT_US |
| 418264008 | SNOMEDCT_US |
| 425138006 | SNOMEDCT_US |
| XTZ6AXU7KN | INXIGHT DRUGS |
Pharmaceutical products:
None