| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 970JJ37FPW |
| InChI Key | KVLFRAWTRWDEDF-IRXDYDNUSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C25H31N5O4 |
| Molecular Weight | 465.55 |
| AlogP | 2.64 |
| Hydrogen Bond Acceptor | 9.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 93.07 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 34.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| INHIBITOR | Serine/threonine-protein kinase mTOR inhibitor | PubMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Kinase
Protein Kinase
Atypical protein kinase group
Atypical protein kinase PIKK family
Atypical protein kinase FRAP subfamily
|
- | 0-8 | - | - | - | |
|
Enzyme
Transferase
|
- | 3600 | - | - | 12 | |
|
Enzyme
|
- | 0-8 | - | - | 12 | |
|
Ion channel
Voltage-gated ion channel
Potassium channels
Voltage-gated potassium channel
|
- | 30400 | - | - | - | |
|
Other cytosolic protein
|
- | 3 | - | - | - | |
|
Unclassified protein
|
- | 1-27 | - | - | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Carcinoma, Hepatocellular | 1 | D006528 | ClinicalTrials |
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Glioblastoma | 1 | D005909 | ClinicalTrials |
| Lymphoma | 1 | D008223 | ClinicalTrials |
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Astrocytoma | 1 | D001254 | ClinicalTrials |
| Oligodendroglioma | 1 | D009837 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEBI | 91329 |
| ChEMBL | CHEMBL1801204 |
| DrugBank | DB12774 |
| FDA SRS | 970JJ37FPW |
| Guide to Pharmacology | 7714 |
| PubChem | 25262965 |
| SureChEMBL | SCHEMBL298416 |
| ZINC | ZINC000052509466 |