Compound Detail
CHEMBL316336
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 | CHEMBL316336 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CKCBFSYZMMHVKT-NTEUORMPSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
368.5
MW (Da)
6.66
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.66
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha CHEMBL2061 | EC50 | 6.95 | 6.95 | 112.0 | 1 |
| Retinoic acid receptor beta CHEMBL2008 | EC50 | 5.97 | 5.97 | 1080.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha | EC50 | = | 112.0 | nM | 6.95 | Transcriptional activation of Retinoid X receptor RXR alpha | 7636843 |
| Retinoic acid receptor beta | EC50 | = | 1080.0 | nM | 5.97 | Transcriptional activation of Retinoic acid receptor RAR beta | 7636843 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7636843 | 10.1021/jm00015a004 | Retinoic acid receptor alpha | 1 |
| 7636843 | 10.1021/jm00015a004 | Retinoic acid receptor beta | 1 |
| 7636843 | 10.1021/jm00015a004 | Retinoic acid receptor gamma | 1 |
| 7636843 | 10.1021/jm00015a004 | Retinoic acid receptor RXR-alpha | 1 |
Data from ChEMBL 36 via Core Engine