Compound Detail
CHEMBL4578881
SEL-120 Phase I
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Phase I
Basic Information
| ChEMBL ID | CHEMBL4578881 |
| Name | SEL-120 |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | GQXLWUCQESKBSC-UHFFFAOYSA-N |
| Parent Compound | CHEMBL4225966 |
| Active Moiety | CHEMBL4225966 |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
9
Publications
4
Known Names
Molecular Properties
414.1
MW (Da)
3.23
ALogP
4
HBA
1
HBD
33.1
PSA (Ų)
0.78
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
IC50 4 meas. best 8.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cyclin-dependent kinase 8 CHEMBL5719 | IC50 | 8.36 | 6.9733 | 4.4 | 3 |
| Cyclin-dependent kinase 19 CHEMBL6002 | IC50 | 7.98 | 7.98 | 10.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cyclin-dependent kinase 8 | IC50 | = | 4.4 | nM | 8.36 | Inhibition of CDK8 (unknown origin) | 30594029 |
| Cyclin-dependent kinase 19 | IC50 | = | 10.4 | nM | 7.98 | Inhibition of CDK19 (unknown origin) | 30594029 |
| Cyclin-dependent kinase 8 | IC50 | = | 37.2 | nM | 7.43 | Inhibition of CDK8 (unknown origin) incubated in presence of ATP by ADP-Glo kina... | 36068975 |
| Cyclin-dependent kinase 8 | IC50 | = | 7400.0 | nM | 5.13 | Inhibition of CDK8 in human HCT-116 cells transfected with TOPFlash luciferase r... | 36068975 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36068975 | 10.1021/acs.jmedchem.2c00820 | Unchecked | 4 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | Cyclin-dependent kinase 8 | 3 |
| 30594029 | 10.1016/j.ejmech.2018.11.076 | Cyclin-dependent kinase 8 | 1 |
| 30594029 | 10.1016/j.ejmech.2018.11.076 | Cyclin-dependent kinase 19 | 1 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | HCT-116 | 1 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | HT-29 | 1 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | SW480 | 1 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | CT26 | 1 |
| 36068975 | 10.1021/acs.jmedchem.2c00820 | GES1 | 1 |
Data from ChEMBL 36 via Core Engine