Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2064032

VONOPRAZAN FUMARATE
💊 Approved Drug
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
💊 Approved Drug
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1.O=C(O)/C=C/C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2064032
Name VONOPRAZAN FUMARATE
Phase Approved
Structure Type MOL
InChI Key ROGSHYHKHPCCJW-WLHGVMLRSA-N
Therapeutic ✓ Yes
Parent Compound CHEMBL2079130
Active Moiety CHEMBL2079130

Known Names

Tak 438 TAK-438 TAK-438 monofumarate Vonoprazan fumarate Vonoprazan monofumarate Voquezna
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
6
Known Names
5
Indications
1
Mechanisms

Molecular Properties

345.4
MW (Da)
2.65
ALogP
5
HBA
1
HBD
64.0
PSA (Ų)
0.77
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2022
Availability Prescription
Chirality Achiral

Routes of Administration

Oral

Flags

First in Class
USAN Stem -prazan
USAN Year 2019

Extended Properties

Molecular Formula C21H20FN3O6S
MW 461.47
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.34

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Potassium-transporting ATPase inhibitor INHIBITOR Potassium-transporting ATPase ✓ ✓

Indications

Duodenal Ulcer Gastroesophageal Reflux Helicobacter Infections Stomach Ulcer Esophagitis

Activity Summary

IC50 1 meas. best 7.72

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 7.72 7.72 19.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 19.0 nM 7.72 Inhibition of swine H+/K+-ATPase after 30 mins by colorimetry 22512618

Literature References

PubMed DOI Target Context # Activities
22512618 10.1021/jm300318t Rattus norvegicus 3
22512618 10.1021/jm300318t Canis familiaris 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
22512618 10.1021/jm300318t Unchecked 1
22512618 10.1021/jm300318t No relevant target 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1

Data from ChEMBL 36 via Core Engine