Compound Detail
CHEMBL2159858
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Basic Information
| ChEMBL ID | CHEMBL2159858 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JJRIUMZXMAWBNV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
472.7
MW (Da)
5.39
ALogP
4
HBA
1
HBD
72.5
PSA (Ų)
0.39
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sentrin-specific protease 1 CHEMBL1909484 | IC50 | 5.93 | 5.93 | 1175.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sentrin-specific protease 1 | IC50 | = | 1175.0 | nM | 5.93 | Inhibition of recombinant His-tagged SENP1 catalytic domain expressed in Escheri... | 23044371 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23044371 | 10.1016/j.bmcl.2012.09.037 | Sentrin-specific protease 1 | 1 |
Data from ChEMBL 36 via Core Engine