Synonyms: | |
Status: | Approved (2015) |
Entry Type: | Small molecule |
Molecule Category: | UKNOWN |
ATC: | L01ED03 |
UNII: | LIJ4CT1Z3Y |
InChI Key | KDGFLJKFZUIJMX-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C30H34N4O2 |
Molecular Weight | 482.63 |
AlogP | 4.77 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 3.0 |
Polar Surface Area | 72.36 |
Molecular species | NEUTRAL |
Aromatic Rings | 3.0 |
Heavy Atoms | 36.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase SRPK family
|
- | 195 | - | - | - | |
Enzyme
Kinase
Protein Kinase
Other protein kinase group
Other protein kinase NAK family
|
- | - | - | - | 79 | |
Enzyme
Kinase
Protein Kinase
TKL protein kinase group
TKL protein kinase STKR family
TKL protein kinase STKR Type 1 subfamily
|
- | 1-19 | - | - | - | |
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase Ret family
|
- | 5-40 | - | - | - | |
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase Sev family
|
- | - | - | 2000-2400 | - | |
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase VEGFR family
|
- | 1400-1400 | - | - | - | |
Unclassified protein
|
- | 2-207 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Neoplasms | 4 | D009369 | ClinicalTrials |
Carcinoma, Non-Small-Cell Lung | 3 | D002289 | ClinicalTrials |
Liver Diseases | 1 | D008107 | ClinicalTrials |
Glioblastoma | 1 | D005909 | ClinicalTrials |
Glioma | 1 | D005910 | ClinicalTrials |
Resources | Reference |
---|---|
ChEBI | 90936 |
ChEMBL | CHEMBL1738797 |
DrugBank | DB11363 |
DrugCentral | 4937 |
EPA CompTox | DTXSID50154840 |
FDA SRS | LIJ4CT1Z3Y |
Guide to Pharmacology | 7739 |
PDB | EMH |
PharmGKB | PA166160050 |
SureChEMBL | SCHEMBL896753 |
ZINC | ZINC000066166864 |