Compound Detail
CHEMBL5584185
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Basic Information
| ChEMBL ID | CHEMBL5584185 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VXGZVULSEFHJSP-SFHVURJKSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
402.5
MW (Da)
2.66
ALogP
7
HBA
0
HBD
60.9
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | IC50 | 7.31 | 6.68 | 49.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 4 | IC50 | = | 49.0 | nM | 7.31 | Inhibition of BRD4 BD1 (unknown origin) | 38876177 |
| Bromodomain-containing protein 4 | IC50 | = | 900.0 | nM | 6.05 | Inhibition of BRD4 BD2 (unknown origin) | 38876177 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38876177 | 10.1016/j.bmcl.2024.129849 | Bromodomain-containing protein 4 | 2 |
| 38876177 | 10.1016/j.bmcl.2024.129849 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine