Compound Detail
CHEMBL1958337
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1958337 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UYIVCPRWMLOCSB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
323.8
MW (Da)
3.43
ALogP
5
HBA
0
HBD
46.3
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | Kd | 6.19 | 6.19 | 640.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 4 | Kd | = | 640.0 | nM | 6.19 | Binding affinity to BRD4-BD1 by isothermal titration calorimetry | 22137933 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22137933 | 10.1016/j.bmc.2011.10.080 | Bromodomain-containing protein 4 | 6 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Bromodomain-containing protein 2 | 4 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Bromodomain-containing protein 3 | 4 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Bromodomain testis-specific protein | 2 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Bromodomain adjacent to zinc finger domain protein 2B | 2 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | CREB-binding protein | 2 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Unchecked | 2 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Protein polybromo-1 | 2 |
| 22137933 | 10.1016/j.bmc.2011.10.080 | Histone acetyltransferase KAT2B | 2 |
Data from ChEMBL 36 via Core Engine