Compound Detail
CHEMBL4776992
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Basic Information
| ChEMBL ID | CHEMBL4776992 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WBHQPLISMLDBLH-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
415.4
MW (Da)
4.98
ALogP
4
HBA
1
HBD
70.1
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDK8/Cyclin C CHEMBL3038474 | IC50 | 7.84 | 7.84 | 14.4 | 1 |
| Cyclin-C/Cyclin-dependent kinase 19 CHEMBL3883323 | IC50 | 7.78 | 7.78 | 16.7 | 1 |
| Serine/threonine-protein kinase haspin CHEMBL1075163 | IC50 | 6.63 | 6.63 | 233.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDK8/Cyclin C | IC50 | = | 14.4 | nM | 7.84 | CDK8/Cyclin C Binding Assay: The binding assay relies on the LanthaScreen Eu-Ki... | - |
| Cyclin-C/Cyclin-dependent kinase 19 | IC50 | = | 16.7 | nM | 7.78 | CDK19/Cyclin C Binding Assay: The binding assay relies on the LanthaScreen Eu-K... | - |
| Serine/threonine-protein kinase haspin | IC50 | = | 233.0 | nM | 6.63 | Haspin Kinase Assay: The kinase assay relies on ADP-GloKM biochemical kinase ass... | - |
Data from ChEMBL 36 via Core Engine