Compound Detail
CHEMBL3092465
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Basic Information
| ChEMBL ID | CHEMBL3092465 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BJRYMGKNXLWDQJ-UHFFFAOYSA-N |
1
Targets
6
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
404.5
MW (Da)
3.31
ALogP
6
HBA
2
HBD
124.4
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 CHEMBL2343 | IC50 | 8.52 | 7.6433 | 3.0 | 6 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 3.0 | nM | 8.52 | Inhibition of recombinant human SGK-1 expressed in baculovirus expression system... | 24900601 |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 3.0 | nM | 8.52 | Inhibition of human SGK1 using fluo-5(6)-carboxyfluorescein)-RPRAATF-NH2 fluores... | 25589934 |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 3.0 | nM | 8.52 | Enzymatic Activity Assay: The compounds were tested for serum and glucocorticoid... | - |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 3.0 | nM | 8.52 | Enzymatic Activity Assay: The enzyme reaction was carried out in a buffer contai... | - |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 580.0 | nM | 6.24 | Inhibition of human SGK1 using fluo-5(6)-carboxyfluorescein)-RPRAATF-NH2 fluores... | 25589934 |
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 2900.0 | nM | 5.54 | Inhibition of recombinant human SGK1 (S61 to L431, S422D) expressed in human U20... | 24900601 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900601 | 10.1021/ml400389a | Serine/threonine-protein kinase Sgk1 | 2 |
| 25589934 | 10.1021/ml5003376 | Serine/threonine-protein kinase Sgk1 | 2 |
Data from ChEMBL 36 via Core Engine