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Compound Detail

CHEMBL1165

MOEXIPRIL
💊 Approved Drug
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💊 Approved Drug
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1Cc2cc(OC)c(OC)cc2C[C@H]1C(=O)O

Basic Information

ChEMBL ID CHEMBL1165
Name MOEXIPRIL
Phase Approved
Structure Type MOL
InChI Key UWWDHYUMIORJTA-HSQYWUDLSA-N
Therapeutic ✓ Yes
Active Moiety CHEMBL1201405

Known Names

Moexipril RS-10085 Uniretic
1
Targets
2
Activities
1
Assay Types
2
PK Parameters
20
Publications
3
Known Names
2
Indications

Molecular Properties

498.6
MW (Da)
2.58
ALogP
7
HBA
2
HBD
114.4
PSA (Ų)
0.45
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 1995
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Oral

Flags

Black Box Warning Natural Product Prodrug
USAN Stem -pril
USAN Year 1995

Extended Properties

Molecular Formula C27H34N2O7
MW 498.58
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.15

Indications

Cardiovascular Diseases Liver Cirrhosis, Biliary

ATC Classification

C09AA13
moexipril
Level 1: CARDIOVASCULAR SYSTEM
Level 2: AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM

Activity Summary

IC50 2 meas. best 8.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Angiotensin-converting enzyme
CHEMBL1808
IC50 8.59 7.92 2.6 2

Pharmacokinetic Data

Parameter Value Units Species
CL 8.0 mL.min-1.g-1 Homo sapiens
F 13.0 % Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16472241 10.2174/1570163043334794 Hepatotoxicity 18
22194678 10.1371/journal.pcbi.1002310 Hepatotoxicity 14
3020249 10.1021/jm00160a026 Rattus norvegicus 8
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
26948801 10.1016/j.drudis.2016.02.015 Homo sapiens 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
20020916 10.1080/15376510701857262 Phospholipidosis 1
- 10.1101/2020.04.21.054387 SARS-CoV-2 1
21112128 10.1016/j.ejmech.2010.11.005 ADMET 1
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 1
37468498 10.1038/s41467-023-40064-9 Voltage-gated inwardly rectifying potassium channel KCNH2 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent dopamine transporter 1
37468498 10.1038/s41467-023-40064-9 Estrogen receptor 1
17870541 10.1016/j.bmc.2007.08.060 Homo sapiens 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent noradrenaline transporter 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent serotonin transporter 1
10669559 10.1021/jm990412m Angiotensin-converting enzyme 1

Data from ChEMBL 36 via Core Engine