Compound Detail
CHEMBL3425765
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Basic Information
| ChEMBL ID | CHEMBL3425765 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QNFFQLHRCGJHHN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
6
Publications
0
Known Names
Molecular Properties
356.5
MW (Da)
5.10
ALogP
4
HBA
1
HBD
62.7
PSA (Ų)
0.71
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha CHEMBL2061 | EC50 | 6.77 | 6.77 | 169.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 18800.0 | ng.hr.mL-1 | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Retinoic acid receptor RXR-alpha | EC50 | = | 169.0 | nM | 6.77 | Agonist activity at RXRalpha (unknown origin) expressed in COS1 cells incubated ... | 25815156 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25815156 | 10.1021/ml500511m | Retinoic acid receptor RXR-alpha | 2 |
| 25815156 | 10.1021/ml500511m | Nucleic Acid | 1 |
| 25815156 | 10.1021/ml500511m | Brain | 1 |
| 25815156 | 10.1021/ml500511m | Plasma | 1 |
| 25815156 | 10.1021/ml500511m | No relevant target | 1 |
| 25815156 | 10.1021/ml500511m | Blood | 1 |
Data from ChEMBL 36 via Core Engine