Compound Detail
CHEMBL1185123
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Basic Information
| ChEMBL ID | CHEMBL1185123 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FDRCPKDOFXMKBN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
346.4
MW (Da)
3.73
ALogP
4
HBA
1
HBD
65.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha CHEMBL2061 | EC50 | 4.79 | 4.79 | 16400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha | EC50 | = | 16400.0 | nM | 4.79 | Activation of human RXRalpha activity expressed in COS1 cells after 12 hrs by RX... | 23472886 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23472886 | 10.1021/jm400026k | Vitamin D3 receptor | 2 |
| 23472886 | 10.1021/jm400026k | Retinoic acid receptor RXR-alpha | 2 |
| 23472886 | 10.1021/jm400026k | COS-1 | 1 |
Data from ChEMBL 36 via Core Engine