Compound Detail
CHEMBL3659976
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Basic Information
| ChEMBL ID | CHEMBL3659976 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KEXGXGBRSMTTRI-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
353.3
MW (Da)
3.70
ALogP
3
HBA
3
HBD
86.5
PSA (Ų)
0.52
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3-phosphoinositide-dependent protein kinase 1 CHEMBL2534 | IC50 | 6.55 | 6.26 | 280.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 3-phosphoinositide-dependent protein kinase 1 | IC50 | = | 280.0 | nM | 6.55 | Binding Assay: The secondary assay was a time resolved-FRET LanthaScreen Kinase ... | - |
| 3-phosphoinositide-dependent protein kinase 1 | IC50 | = | 300.0 | nM | 6.52 | Inhibition of PDK1 (unknown origin) after 1 hr in presence of Ser/Thr-07 by fluo... | 29150397 |
| 3-phosphoinositide-dependent protein kinase 1 | IC50 | = | 1940.0 | nM | 5.71 | Activity Assay: The primary assay for compound inhibitory activity was the ATP d... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29150397 | 10.1016/j.bmcl.2017.10.041 | 3-phosphoinositide-dependent protein kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine