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

Stem definitionDrug idCAS RN
4676 7683-36-5

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • obidoxime
  • obidoxime chloride
  • toxogonin
  • obidoxim
Cholinesterase reactivator occurring in two interchangeable isomeric forms, syn and anti.
  • Molecular weight: 288.31
  • Formula: C14H16N4O3
  • CLOGP: -5.97
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 2
  • TPSA: 82.17
  • ALOGS: -5.53
  • ROTB: 6

Drug dosage:

None

ADMET properties:

PropertyValueReference
Vd (Volume of distribution) 0.17 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 1.90 mL/min/kg Lombardo F, Berellini G, Obach RS
t_half (Half-life) 1.20 hours Lombardo F, Berellini G, Obach RS
BA (Bioavailability) 0 %

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,ACVRL1,AKT2,AKT3,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GRK3,GSK3B,IGF1R,ITK,JAK1,JAK2,JAK3,KIT,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPK8,MAPK9,MAPKAPK2,MAPKAPK5,MARK4,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ZAP70 65
kinase-selectivity-class ACVR2B,AXL,BRAF,CDK4,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,GRK2,MAP2K6,MAPK12,MAPK7,MAPK8,PRKDC,STK33,SYK,TEK,TGFBR1,TTK 20
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 V03AB13 VARIOUS
ALL OTHER THERAPEUTIC PRODUCTS
ALL OTHER THERAPEUTIC PRODUCTS
Antidotes
MeSH PA D002801 Cholinesterase Reactivators
MeSH PA D018377 Neurotransmitter Agents
MeSH PA D018678 Cholinergic Agents
CHEBI has role CHEBI:50241 cholinesterase reactivator

Related Drugs by ATC class:

V03AB Antidotes 28 drugs

Drug Use | Suggest Off label Use Form| |View source of the data|

DiseaseRelationSNOMED_IDDOID
Organophosphate poisoning indication 8260003




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 8.14 acidic
pKa2 8.74 acidic

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
Acetylcholinesterase Enzyme Kd 4.67 CHEMBL

External reference:

IDSource
D05215 KEGG_DRUG
OBI PDB_CHEM_ID
CHEMBL451635 ChEMBL_ID
CHEMBL291233 ChEMBL_ID
114-90-9 SECONDARY_CAS_RN
DB13750 DRUGBANK_ID
N6KNE1QA9O UNII
42826 RXNORM
006771 NDDF
006772 NDDF
1156231009 SNOMEDCT_US
1156241007 SNOMEDCT_US
C0086728 UMLSCUI
D009768 MESH_DESCRIPTOR_UI
CHEBI:44691 CHEBI
135412781 PUBCHEM_CID
2138 INN_ID

Pharmaceutical products:

None