Compound Detail
CHEMBL4469440
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Basic Information
| ChEMBL ID | CHEMBL4469440 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YLHYEJJMEGMATE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
353.4
MW (Da)
3.48
ALogP
6
HBA
2
HBD
83.1
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ubiquitin carboxyl-terminal hydrolase 8 CHEMBL2157854 | IC50 | 4.79 | 4.79 | 16200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ubiquitin carboxyl-terminal hydrolase 8 | IC50 | = | 16200.0 | nM | 4.79 | Inhibition of N-terminal His6-tagged USP8 (unknown origin) catalytic domain (734... | 35786929 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31238183 | 10.1016/j.ejmech.2019.06.024 | CDK2/Cyclin A2 | 1 |
| 31238183 | 10.1016/j.ejmech.2019.06.024 | CDK9/cyclin T1 | 1 |
| 31238183 | 10.1016/j.ejmech.2019.06.024 | HepG2 | 1 |
| 35786929 | 10.1021/acs.jmedchem.2c00013 | Ubiquitin carboxyl-terminal hydrolase 8 | 1 |
Data from ChEMBL 36 via Core Engine