clemizole 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
672 442-52-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • clemizole
  • lergopenin
  • clemizole hydrochloride
  • clemizole HCl
  • Molecular weight: 325.84
  • Formula: C19H20ClN3
  • CLOGP: 4.28
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 0
  • TPSA: 21.06
  • ALOGS: -4.21
  • ROTB: 4

Drug dosage:

None

ADMET properties:

PropertyValueReference
S (Water solubility) 6.52 mg/mL Bocci G, Oprea TI, Benet LZ
BDDCS (Biopharmaceutical Drug Disposition Classification System) 1 Bocci G, Oprea TI, Benet LZ

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
CHEBI has role CHEBI:37956 antihistamines

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

Dissociation levelDissociation constantType (acidic/basic)
pKa1 7.86 Basic
pKa2 6.27 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
Histamine H4 receptor GPCR Ki 6.40 PDSP
Short transient receptor potential channel 4 Ion channel BLOCKER IC50 5.19 IUPHAR
Short transient receptor potential channel 5 Ion channel BLOCKER IC50 5.96 IUPHAR
Short transient receptor potential channel 3 Ion channel BLOCKER IC50 5.04 IUPHAR
Short transient receptor potential channel 6 Ion channel BLOCKER IC50 5.89 IUPHAR
Heme oxygenase 2 Enzyme IC50 5.47 CHEMBL
Short transient receptor potential channel 4 Ion channel IC50 5.19 CHEMBL
Short transient receptor potential channel 5 Ion channel IC50 5.96 CHEMBL
Short transient receptor potential channel 7 Ion channel IC50 4.58 CHEMBL

External reference:

IDSource
D01705 KEGG_DRUG
C0008931 UMLSCUI
CHEBI:52140 CHEBI
GX0 PDB_CHEM_ID
CHEMBL1407943 ChEMBL_ID
DB15932 DRUGBANK_ID
C084582 MESH_SUPPLEMENTAL_RECORD_UI
2782 PUBCHEM_CID
10285 IUPHAR_LIGAND_ID
826 INN_ID
1163-36-6 SECONDARY_CAS_RN
T97CB3796L UNII
006929 NDDF
006930 NDDF
12821002 SNOMEDCT_US
CHEMBL1256817 ChEMBL_ID

Pharmaceutical products:

None