Compound Detail
CHEMBL1534525
MIBEFRADIL DIHYDROCHLORIDE 💊 Approved Drug
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💊 Approved Drug
COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc2cc(F)ccc2[C@@H]1C(C)C.Cl.Cl
Basic Information
| ChEMBL ID | CHEMBL1534525 |
| Name | MIBEFRADIL DIHYDROCHLORIDE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | MTJLQTFHJIHXIX-GDUXWEAWSA-N |
| Therapeutic | ✓ Yes |
| Parent Compound | CHEMBL45816 |
| Active Moiety | CHEMBL45816 |
3
Targets
17
Activities
1
Assay Types
0
PK Parameters
7
Publications
5
Known Names
1
Mechanisms
Molecular Properties
495.6
MW (Da)
5.27
ALogP
5
HBA
1
HBD
67.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1997 |
| Availability | Withdrawn |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Voltage-gated T-type calcium channel blocker | BLOCKER | Voltage-gated T-type calcium channel | ✓ | ✓ |
Drug Warnings
Withdrawn
General Warning
potential to induce cardiac arrhythmias (including torsades de pointes) especially when taken concomitantly with other medications
Withdrawn
General Warning
associated with potentially harmful interactions with other drugs. Mibefradil dihydrochloride reduced the activity of certain liver enzymes that are important in helping the body eliminate many other ...
Withdrawn
cardiotoxicity
potential to induce cardiac arrhythmias (including torsades de pointes) especially when taken concomitantly with other medications
Withdrawn
cardiotoxicity
potential to induce cardiac arrhythmias (including torsades de pointes) especially when taken concomitantly with other medications
Activity Summary
IC50 17 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.4 | 5.7714 | 398.1 | 7 |
| Unchecked CHEMBL612545 | IC50 | 5.51 | 5.1844 | 3078.2 | 9 |
| Potassium channel subfamily K member 9 CHEMBL2321614 | IC50 | 4.61 | 4.61 | 24600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19734910 | 10.1038/nchembio.215 | Plasmodium falciparum | 7 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| 17417631 | 10.1038/nchembio873 | Unchecked | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| 31260312 | 10.1021/acs.jmedchem.9b00248 | Potassium channel subfamily K member 9 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
| - | 10.6019/EOS300108 | HepG2 | 1 |
Data from ChEMBL 36 via Core Engine