Compound Detail
CHEMBL361537
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Basic Information
| ChEMBL ID | CHEMBL361537 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XCMMYOKHRXXUKN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
305.3
MW (Da)
4.75
ALogP
4
HBA
1
HBD
55.5
PSA (Ų)
0.59
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.23
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cyclin-dependent kinase 5/CDK5 activator 1 CHEMBL1907600 | IC50 | 5.23 | 5.23 | 5900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cyclin-dependent kinase 5/CDK5 activator 1 | IC50 | = | 5900.0 | nM | 5.23 | Inhibitory concentration tested against Cyclin-dependent kinase 5 | 15664865 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15664865 | 10.1016/j.bmcl.2004.10.091 | Cyclin-dependent kinase 1/cyclin B1 | 1 |
| 15664865 | 10.1016/j.bmcl.2004.10.091 | Cyclin-dependent kinase 5/CDK5 activator 1 | 1 |
| 15664865 | 10.1016/j.bmcl.2004.10.091 | Cyclin-dependent kinase 2/cyclin E1 | 1 |
| 15664865 | 10.1016/j.bmcl.2004.10.091 | Cyclin-dependent kinase 4/cyclin D1 | 1 |
Data from ChEMBL 36 via Core Engine