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eugenol đ¶ Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |
| Stem definition | Drug id | CAS RN |
|---|---|---|
| 4648 | 97-53-0 |
Description:
| Molecule | Description |
|---|---|
|
Synonyms:
|
A cinnamate derivative of the shikamate pathway found in CLOVE OIL and other PLANTS.
|
Drug dosage:
None
ADMET properties:
None
Predicted pharmacokinetic/toxicological properties (PK-AZ):
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,IKBKB,ITK,JAK1,JAK2,JAK3,KIT,MAP2K6,MAP3K21,MAP3K7,MAPK1,MAPK10,MAPK7,MAPK8,MAPK9,MAPKAPK2,MARK4,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ZAP70 | 59 | |||
| kinase-selectivity-class | ACVR2A,ACVR2B,ACVRL1,AXL,BRAF,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,MAP2K6,MAPK12,MAPK7,MAPK8,PIK3CD,PRKDC,SIK2,STK33,TEK,TGFBR1,TTK | 23 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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)
None
FDA Adverse Event Reporting System (Pediatric)
None
Pharmacologic Action:
| Source | Code | Description |
|---|---|---|
| FDA CS | M0000728 | Allergens |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D012997 | Solvents |
| CHEBI has role | CHEBI:27311 | volatile oil component |
| CHEBI has role | CHEBI:33282 | antibacterial agent |
| CHEBI has role | CHEBI:35480 | analgesic |
| CHEBI has role | CHEBI:35610 | antineoplastic agent |
| CHEBI has role | CHEBI:35617 | flavouring agent |
| CHEBI has role | CHEBI:38623 | EC 1.4.3.4 (monoamine oxidase) inhibitor |
| CHEBI has role | CHEBI:38634 | voltage-gated sodium channel blocker |
| CHEBI has role | CHEBI:38867 | anaesthetic |
| CHEBI has role | CHEBI:48578 | radical scavenger |
| CHEBI has role | CHEBI:50904 | allergen |
| CHEBI has role | CHEBI:67079 | anti-inflammatory agent |
| CHEBI has role | CHEBI:68495 | apoptosis inducer |
| CHEBI has role | CHEBI:73240 | NF-ÎșB inhibitor |
| CHEBI has role | CHEBI:85234 | human blood serum metabolite |
| CHEBI has role | CHEBI:139492 | sensitiser |
| FDA PE | N0000175629 | Increased Histamine Release |
| FDA PE | N0000184306 | Cell-mediated Immunity |
| FDA EPC | N0000185508 | Standardized Chemical Allergen |
Drug Use | Suggest Off label Use Form| |View source of the data|
None
đ¶ Veterinary Drug Use
None
đ¶ Veterinary products
None
Acid dissociation constants calculated using MoKa v3.0.0
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 10.12 | acidic |
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 |
|---|---|---|---|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 | Enzyme | IC50 | 4.96 | CHEMBL | |||||
| Arachidonate 5-lipoxygenase | Enzyme | IC50 | 4.58 | CHEMBL | |||||
| Transient receptor potential cation channel subfamily M member 8 | Ion channel | EC50 | 4.18 | CHEMBL |
External reference:
| ID | Source |
|---|---|
| D04117 | KEGG_DRUG |
| 4019118 | VUID |
| N0000147369 | NUI |
| 4019118 | VANDF |
| C0015153 | UMLSCUI |
| CHEBI:4917 | CHEBI |
| EOL | PDB_CHEM_ID |
| CHEMBL42710 | ChEMBL_ID |
| DB09086 | DRUGBANK_ID |
| 2425 | IUPHAR_LIGAND_ID |
| 3T8H1794QW | UNII |
| 3314 | PUBCHEM_CID |
| 4186 | RXNORM |
| 12028 | MMSL |
| NOCODE | MMSL |
| 001106 | NDDF |
| 255924000 | SNOMEDCT_US |
| 411361005 | SNOMEDCT_US |
| D005054 | MESH_DESCRIPTOR_UI |
| 3T8H1794QW | INXIGHT DRUGS |
Pharmaceutical products:
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Red Cross Toothache | HUMAN OTC DRUG LABEL | 1 | 10742-0009 | LIQUID | 850 mg | TOPICAL | OTC Monograph Drug | 11 sections |
| AnaDent Childrens Kanka Gel | HUMAN OTC DRUG LABEL | 1 | 27854-178 | GEL | 12 mg | DENTAL | OTC Monograph Drug | 11 sections |
| DenTek Eugenol | HUMAN OTC DRUG LABEL | 1 | 60630-566 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 12 sections |
| Walgreens Natural Eugenol/Toothache Medicationwith cotton pellets and tweezers | HUMAN OTC DRUG LABEL | 1 | 60630-608 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 9 sections |
| DenTek Eugenol | HUMAN OTC DRUG LABEL | 1 | 67659-400 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 12 sections |
| Walgreens Natural Eugenol/Toothache Medicationwith cotton pellets and tweezers | HUMAN OTC DRUG LABEL | 1 | 67659-405 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 9 sections |
| Eugenol Toothache Medication | HUMAN OTC DRUG LABEL | 1 | 67659-415 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 12 sections |
| Nuby Teething Gel | HUMAN OTC DRUG LABEL | 1 | 70797-230 | GEL | 13 mg | TOPICAL | OTC monograph not final | 8 sections |
| Nuby Teething Gel | HUMAN OTC DRUG LABEL | 1 | 71552-231 | GEL | 8 mg | TOPICAL | OTC monograph not final | 8 sections |
| PainONil | HUMAN OTC DRUG LABEL | 3 | 73417-758 | OINTMENT | 20 mg | TOPICAL | OTC monograph not final | 13 sections |
| TotalArthritis | HUMAN OTC DRUG LABEL | 3 | 73417-852 | OINTMENT | 40 mg | TOPICAL | OTC monograph not final | 13 sections |
| Anubis Barcelona | HUMAN OTC DRUG LABEL | 24 | 83021-553 | CREAM | 0.00 g | TOPICAL | OTC monograph final | 9 sections |
| DenTek Eugenol | HUMAN OTC DRUG LABEL | 1 | 83062-400 | LIQUID | 850 mg | DENTAL | OTC monograph not final | 12 sections |