Compound Detail
CHEMBL476123
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Basic Information
| ChEMBL ID | CHEMBL476123 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKKZIVOCUDNMCA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
3.32
ALogP
7
HBA
1
HBD
83.3
PSA (Ų)
0.77
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase PLK1 CHEMBL3024 | IC50 | 5.8 | 5.8 | 1600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase PLK1 | IC50 | = | 1600.0 | nM | 5.8 | Inhibition of PLK1 | 18762425 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18762425 | 10.1016/j.bmcl.2008.08.033 | Serine/threonine-protein kinase PLK1 | 1 |
Data from ChEMBL 36 via Core Engine