Compound Detail
CHEMBL3128155
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 | CHEMBL3128155 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XNQMCETZESRASO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
177.2
MW (Da)
0.79
ALogP
3
HBA
1
HBD
63.1
PSA (Ų)
0.65
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.06 | 4.795 | 8700.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 8700.0 | nM | 5.06 | Inhibition of 20s constitutive proteasome beta 2 subunit trypsin-like activity i... | 24534487 |
| Unchecked | IC50 | = | 29400.0 | nM | 4.53 | Inhibition of 20s constitutive proteasome beta 5 subunit chymotrypsin-like activ... | 24534487 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24534487 | 10.1016/j.bmcl.2014.01.072 | Unchecked | 3 |
| 24534487 | 10.1016/j.bmcl.2014.01.072 | Cathepsin B | 1 |
| 24534487 | 10.1016/j.bmcl.2014.01.072 | Calpain-1 catalytic subunit | 1 |
Data from ChEMBL 36 via Core Engine