Compound Detail
CHEMBL284167
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 | CHEMBL284167 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UPWZKKIZKAEBKM-NTCAYCPXSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
427.4
MW (Da)
7.06
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.53
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Retinoic acid receptor beta CHEMBL2008 | EC50 | 7.68 | 7.68 | 21.0 | 1 |
| Retinoic acid receptor gamma CHEMBL2003 | EC50 | 7.04 | 7.04 | 91.0 | 1 |
| Retinoic acid receptor RXR-alpha CHEMBL2061 | EC50 | 6.53 | 6.53 | 298.0 | 1 |
| Retinoic acid receptor alpha CHEMBL2055 | EC50 | 6.0 | 6.0 | 989.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Retinoic acid receptor beta | EC50 | = | 21.0 | nM | 7.68 | Transcriptional activation for RAR beta receptor | - |
| Retinoic acid receptor gamma | EC50 | = | 91.0 | nM | 7.04 | Transcriptional activation for RAR gamma receptor | - |
| Retinoic acid receptor RXR-alpha | EC50 | = | 298.0 | nM | 6.53 | Transcriptional activation for RXR alpha receptor | - |
| Retinoic acid receptor alpha | EC50 | = | 989.0 | nM | 6.0 | Transcriptional activation for RAR alpha receptor | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80511-4 | Retinoic acid receptor alpha | 1 |
| - | 10.1016/S0960-894X(01)80511-4 | Retinoic acid receptor beta | 1 |
| - | 10.1016/S0960-894X(01)80511-4 | Retinoic acid receptor gamma | 1 |
| - | 10.1016/S0960-894X(01)80511-4 | Retinoic acid receptor RXR-alpha | 1 |
Data from ChEMBL 36 via Core Engine