Compound Detail
CHEMBL204240
IMEPITOIN 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
Basic Information
| ChEMBL ID | CHEMBL204240 |
| Name | IMEPITOIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IQHYCZKIFIHTAI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
3
Known Names
1
Mechanisms
Molecular Properties
279.7
MW (Da)
2.01
ALogP
3
HBA
0
HBD
45.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| GABA-A receptor; anion channel partial agonist | PARTIAL AGONIST | GABA-A receptor; anion channel | ✓ | ✓ |
Activity Summary
Ki 1 meas. best 5.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL1907607 | Ki | 5.36 | 5.36 | 4350.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | Ki | = | 4350.0 | nM | 5.36 | Binding affinity to Wistar rat benzodiazepine receptor | 16539371 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16539371 | 10.1021/jm0509400 | Mus musculus | 3 |
| 16539371 | 10.1021/jm0509400 | Rattus norvegicus | 3 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 16539371 | 10.1021/jm0509400 | No relevant target | 1 |
| 16539371 | 10.1021/jm0509400 | GABA-A receptor; anion channel | 1 |
| 16539371 | 10.1021/jm0509400 | Cynomolgus monkey | 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