paraoxon 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
4683 311-45-5

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • paraoxon
  • oxyparathion
  • ethyl paraoxon
  • paraoxan
  • phosphachole
  • phosphacol
  • mintacol
An organophosphate cholinesterase inhibitor that is used as a pesticide.
  • Molecular weight: 275.20
  • Formula: C10H14NO6P
  • CLOGP: 1.88
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 0
  • TPSA: 90.58
  • ALOGS: -2.28
  • ROTB: 7

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,ACVRL1,AKT1,AKT2,AKT3,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GRK3,GSK3B,IGF1R,IKBKB,ITK,JAK1,JAK2,JAK3,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK1,MAPK10,MAPK12,MAPK7,MAPK8,MAPK9,MAPKAPK2,MET,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TTK,ULK1,ZAP70 66
kinase-selectivity-class AURKA,AXL,BRAF,CDK4,CDK9,DDR1,DYRK1B,EPHB4,ERBB2,GRK2,IRAK3,JAK1,JAK2,MAP2K3,MAP2K6,MAP3K7,MAPK1,MAPK12,MAPK7,MAPK8,MARK4,MET,MTOR,PDK4,PRKDC,SIK2,STK33,SYK,TEK,TTK,ZAP70 31
pfas-class PFAS structural alert (1 = True, 0 = False) 0

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:

SourceCodeDescription
ATC S01EB10 SENSORY ORGANS
OPHTHALMOLOGICALS
ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Parasympathomimetics
MeSH PA D002800 Cholinesterase Inhibitors
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D007306 Insecticides
MeSH PA D010575 Pesticides
MeSH PA D018377 Neurotransmitter Agents
MeSH PA D018678 Cholinergic Agents
CHEBI has role CHEBI:38462 EC 3.1.1.7 (acetylcholinesterase) inhibitor
CHEBI has role CHEBI:39456 antiglaucoma drug
CHEBI has role CHEBI:75771 mouse metabolite

Related Drugs by ATC class:

S01EB Parasympathomimetics 9 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

None

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Carbonic anhydrase 2 Enzyme IC50 7.23 CHEMBL
Carbonic anhydrase 1 Enzyme IC50 6.47 CHEMBL
Acetylcholinesterase Enzyme IC50 8 CHEMBL
Cholinesterase Enzyme IC50 8.15 CHEMBL
Carbonic anhydrase 13 Enzyme IC50 5.99 CHEMBL
Acetylcholinesterase Enzyme IC50 7.89 CHEMBL
Cannabinoid receptor 1 GPCR IC50 5.92 CHEMBL
Monoglyceride lipase Enzyme IC50 5.92 CHEMBL
Fatty-acid amide hydrolase 1 Enzyme IC50 6.27 CHEMBL

External reference:

IDSource
D10529 KEGG_DRUG
CHEBI:27827 CHEBI
CHEMBL23838 ChEMBL_ID
DB13495 DRUGBANK_ID
Q9CX8P80JW UNII
C0030480 UMLSCUI
D010261 MESH_DESCRIPTOR_UI
9395 PUBCHEM_CID
C121104 MESH_SUPPLEMENTAL_RECORD_UI

Pharmaceutical products:

None