Compound Detail
CHEMBL2159861
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Basic Information
| ChEMBL ID | CHEMBL2159861 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FGTDFTCAYYCPBY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
423.9
MW (Da)
4.64
ALogP
5
HBA
1
HBD
81.7
PSA (Ų)
0.44
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sentrin-specific protease 1 CHEMBL1909484 | IC50 | 5.62 | 5.62 | 2385.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sentrin-specific protease 1 | IC50 | = | 2385.0 | nM | 5.62 | 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 | 2 |
Data from ChEMBL 36 via Core Engine