Compound Detail
CHEMBL340685
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Basic Information
| ChEMBL ID | CHEMBL340685 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FYKMNDNSDHDVSF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
287.3
MW (Da)
2.75
ALogP
3
HBA
2
HBD
74.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cyclin-dependent kinase 4/cyclin D1 CHEMBL1907601 | IC50 | 6.75 | 6.75 | 180.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cyclin-dependent kinase 4/cyclin D1 | IC50 | = | 180.0 | nM | 6.75 | Inhibitory activity against Cyclin D1-cyclin-dependent kinase 4 by measuring the... | 14552791 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14552791 | 10.1016/s0960-894x(03)00791-1 | Cyclin-dependent kinase 4/cyclin D1 | 1 |
| 14552791 | 10.1016/s0960-894x(03)00791-1 | HCT-116 | 1 |
| 14552791 | 10.1016/s0960-894x(03)00791-1 | NCI-H460 | 1 |
Data from ChEMBL 36 via Core Engine