cytisine Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
5217 485-35-8

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • cytisine
  • baptitoxine
  • tabex
  • Molecular weight: 190.25
  • Formula: C11H14N2O
  • CLOGP: 0.01
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 1
  • TPSA: 32.34
  • ALOGS: -1.37
  • ROTB: 0

Drug dosage:

None

ADMET properties:

None

Approvals:

DateAgencyCompanyOrphan
None Health Canada

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
ATC N07BA04 NERVOUS SYSTEM
OTHER NERVOUS SYSTEM DRUGS
DRUGS USED IN ADDICTIVE DISORDERS
Drugs used in nicotine dependence
CHEBI has role CHEBI:47958 nicotinic acetylcholine receptor agonist

Drug Use (View source of the data)

DiseaseRelationSNOMED_IDDOID
Smoking cessation assistance indication 384742004

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 8.18 Basic

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
Neuronal acetylcholine receptor subunit alpha-7 Ion channel Ki 5.85 CHEMBL
Acetylcholine receptor subunit delta Ion channel EC50 4 CHEMBL
Neuronal acetylcholine receptor subunit alpha-7 Ion channel Ki 9.05 CHEMBL
Neuronal acetylcholine receptor subunit alpha-4 Ion channel Ki 9.47 CHEMBL
Nicotinic acetylcholine receptor alpha 5 subunit Ion channel Ki 5.91 CHEMBL
Acetylcholine receptor subunit alpha Ion channel IC50 5.45 CHEMBL

External reference:

IDSource
CHEMBL497939 ChEMBL_ID
D07770 KEGG_DRUG
C5E PDB_CHEM_ID
DB09028 DRUGBANK_ID
CHEBI:4055 CHEBI
5347 IUPHAR_LIGAND_ID
10235 PUBCHEM_CID
C004712 MESH_SUPPLEMENTAL_RECORD_UI
1723152 RXNORM
76283008 SNOMEDCT_US

Pharmaceutical products:

None