Compound Detail
CHEMBL4857902
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Basic Information
| ChEMBL ID | CHEMBL4857902 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNCXVBFGULMEOC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
327.2
MW (Da)
4.65
ALogP
2
HBA
1
HBD
24.9
PSA (Ų)
0.75
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDK8/Cyclin C CHEMBL3038474 | IC50 | 6.74 | 6.74 | 183.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDK8/Cyclin C | IC50 | = | 183.0 | nM | 6.74 | Inhibition of kinase tracer 236 binding to His tagged recombinant human CDK8/cyc... | 35114084 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35114084 | 10.1021/acs.jmedchem.1c01951 | CDK8/Cyclin C | 1 |
| 35114084 | 10.1021/acs.jmedchem.1c01951 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine