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

Stem definitionDrug idCAS RN
dipeptidyl aminopeptidase-IV inhibitors 5054 1226781-44-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • omarigliptin
  • marizev
  • Mk-3102
  • MK3102
  • Molecular weight: 398.43
  • Formula: C17H20F2N4O3S
  • CLOGP: -0.91
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 1
  • TPSA: 90.45
  • ALOGS: -2.87
  • ROTB: 2

Drug dosage:

None

ADMET properties:

None

Approvals:

DateAgencyCompanyOrphan
Sept. 28, 2015 PMDA MSD K.K.

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

None

Drug Use (View source of the data)

DiseaseRelationSNOMED_IDDOID
Diabetes mellitus type 2 indication 44054006 DOID:9352

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 6.94 Basic
pKa2 4.58 Basic
pKa3 0.2 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
Dipeptidyl peptidase 4 Enzyme INHIBITOR Ki 9.10 SCIENTIFIC LITERATURE SCIENTIFIC LITERATURE
Potassium voltage-gated channel subfamily H member 2 Ion channel IC50 4.41 CHEMBL
Dipeptidyl peptidase 4 Enzyme IC50 7.36 CHEMBL

External reference:

IDSource
CVP59Q4JE1 UNII
D10317 KEGG_DRUG
C4279587 UMLSCUI
CHEBI:134735 CHEBI
CHEMBL2105762 ChEMBL_ID
46209133 PUBCHEM_CID
DB11992 DRUGBANK_ID
C587539 MESH_SUPPLEMENTAL_RECORD_UI
8402 IUPHAR_LIGAND_ID
9586 INN_ID

Pharmaceutical products:

None