Compound Detail
CHEMBL3263751
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Basic Information
| ChEMBL ID | CHEMBL3263751 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SYEBWDBFEZMPGA-HSZRJFAPSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
417.5
MW (Da)
5.14
ALogP
5
HBA
1
HBD
85.9
PSA (Ų)
0.70
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mineralocorticoid receptor CHEMBL1994 | IC50 | 7.97 | 7.97 | 10.7 | 1 |
| Progesterone receptor CHEMBL208 | IC50 | 5.66 | 5.66 | 2190.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mineralocorticoid receptor | IC50 | = | 10.7 | nM | 7.97 | Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based... | 24738581 |
| Progesterone receptor | IC50 | = | 2190.0 | nM | 5.66 | Antagonist activity at progesterone receptor (unknown origin) by Gal4-based cell... | 24738581 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24738581 | 10.1021/jm500206r | No relevant target | 2 |
| 24738581 | 10.1021/jm500206r | Mineralocorticoid receptor | 1 |
| 24738581 | 10.1021/jm500206r | Unchecked | 1 |
| 24738581 | 10.1021/jm500206r | Progesterone receptor | 1 |
| 24738581 | 10.1021/jm500206r | Glucocorticoid receptor | 1 |
| 24738581 | 10.1021/jm500206r | Androgen receptor | 1 |
Data from ChEMBL 36 via Core Engine