Compound Detail
CHEMBL1200970
ETHOPROPAZINE HYDROCHLORIDE 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL1200970 |
| Name | ETHOPROPAZINE HYDROCHLORIDE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | VXPCQISYVPFYRK-UHFFFAOYSA-N |
| Therapeutic | ✓ Yes |
| Parent Compound | CHEMBL1206 |
| Active Moiety | CHEMBL1206 |
2
Targets
12
Activities
2
Assay Types
0
PK Parameters
13
Publications
6
Known Names
1
Mechanisms
Molecular Properties
312.5
MW (Da)
5.02
ALogP
3
HBA
0
HBD
6.5
PSA (Ų)
0.77
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1982 |
| Availability | Discontinued |
| Chirality | Racemic |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 antagonist | ANTAGONIST | Muscarinic acetylcholine receptor M1 | ✓ | ✓ |
Activity Summary
IC50 6 meas. best 5.8
Ki 6 meas. best 4.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholinesterase CHEMBL1914 | IC50 | 5.8 | 5.8 | 1600.0 | 3 |
| Acetylcholinesterase CHEMBL220 | Ki | 4.61 | 4.6067 | 24700.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholinesterase | IC50 | = | 1600.0 | nM | 5.8 | Inhibition of human recombinant BChE | 21144749 |
| Cholinesterase | IC50 | = | 1600.0 | nM | 5.8 | Inhibition of human plasmatic BChE by Lineweaver-Burk plot analysis | 21236521 |
| Cholinesterase | IC50 | = | 1600.0 | nM | 5.8 | Inhibition of human plasmatic BChE by modified Ellman's method | 21397501 |
| Acetylcholinesterase | Ki | = | 24700.0 | nM | 4.61 | Inhibition of human recombinant AChE assessed as dissociation constant for enzym... | 21144749 |
| Acetylcholinesterase | Ki | = | 24700.0 | nM | 4.61 | Dissociation constant for enzyme-inhibitor complex of human recombinant AChE by ... | 21236521 |
| Acetylcholinesterase | Ki | = | 25000.0 | nM | 4.6 | Inhibition of human erythrocytes recombinant AChE assessed as dissociation const... | 21397501 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21236521 | 10.1016/j.ejmech.2010.12.011 | Acetylcholinesterase | 3 |
| 21397501 | 10.1016/j.bmcl.2011.02.047 | Acetylcholinesterase | 3 |
| 21144749 | 10.1016/j.bmcl.2010.11.051 | Cholinesterase | 2 |
| 21144749 | 10.1016/j.bmcl.2010.11.051 | Acetylcholinesterase | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 21144749 | 10.1016/j.bmcl.2010.11.051 | Cholinesterases; ACHE & BCHE | 1 |
| 21236521 | 10.1016/j.ejmech.2010.12.011 | Cholinesterase | 1 |
| 21236521 | 10.1016/j.ejmech.2010.12.011 | Cholinesterases; ACHE & BCHE | 1 |
| 21397501 | 10.1016/j.bmcl.2011.02.047 | Cholinesterase | 1 |
| 21397501 | 10.1016/j.bmcl.2011.02.047 | Cholinesterases; ACHE & BCHE | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| - | 10.1101/2020.04.03.023846 | SARS-CoV-2 | 1 |
Data from ChEMBL 36 via Core Engine