Compound Detail
CHEMBL3334958
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Basic Information
| ChEMBL ID | CHEMBL3334958 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QTONPULMKAETEL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
343.5
MW (Da)
4.94
ALogP
5
HBA
1
HBD
54.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 5.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase 17B CHEMBL3980 | Kd | 5.72 | 5.72 | 1900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase 17B | Kd | = | 1900.0 | nM | 5.72 | Binding affinity to DRAK2 (unknown origin) ATP site | 25178155 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25178155 | 10.1021/jm5007929 | Serine/threonine-protein kinase 17B | 2 |
Data from ChEMBL 36 via Core Engine