Compound Detail
CHEMBL3356022
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Basic Information
| ChEMBL ID | CHEMBL3356022 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UDMWFCCCDQUYMB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
364.4
MW (Da)
3.61
ALogP
4
HBA
3
HBD
100.9
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.91
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 CHEMBL2343 | IC50 | 6.91 | 5.96 | 124.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 124.0 | nM | 6.91 | Inhibition of human SGK1 using fluo-5(6)-carboxyfluorescein)-RPRAATF-NH2 fluores... | 25589934 |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 9720.0 | nM | 5.01 | Inhibition of human SGK1 using fluo-5(6)-carboxyfluorescein)-RPRAATF-NH2 fluores... | 25589934 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25589934 | 10.1021/ml5003376 | Serine/threonine-protein kinase Sgk1 | 2 |
Data from ChEMBL 36 via Core Engine