Compound Detail
CHEMBL5877617
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Basic Information
| ChEMBL ID | CHEMBL5877617 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RMYAWBAFOLVCAK-UHFFFAOYSA-N |
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
423.9
MW (Da)
3.93
ALogP
6
HBA
0
HBD
46.4
PSA (Ų)
0.64
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | IC50 | 6.26 | 6.26 | 550.0 | 2 |
| Bromodomain-containing protein 2 CHEMBL1293289 | IC50 | 6.26 | 6.26 | 550.0 | 2 |
| Bromodomain-containing protein 3 CHEMBL1795186 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 2 | IC50 | = | 550.0 | nM | 6.26 | Binding Assay: BRD binding and inhibition was assessed by measuring the interact... | - |
| Bromodomain-containing protein 2 | IC50 | = | 550.0 | nM | 6.26 | Binding Assay: BRD binding and inhibition was assessed by measuring the interact... | - |
| Bromodomain-containing protein 3 | IC50 | = | 550.0 | nM | 6.26 | Binding Assay: BRD binding and inhibition was assessed by measuring the interact... | - |
| Bromodomain-containing protein 4 | IC50 | = | 550.0 | nM | 6.26 | Binding Assay: BRD binding and inhibition was assessed by measuring the interact... | - |
| Bromodomain-containing protein 4 | IC50 | = | 550.0 | nM | 6.26 | Binding Assay: BRD binding and inhibition was assessed by measuring the interact... | - |
Data from ChEMBL 36 via Core Engine