Synonyms: | |
Status: | Phase 2 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | KL2Z2TLF01 |
InChI Key | PDOQBOJDRPLBQU-QMMMGPOBSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C14H14ClFN8 |
Molecular Weight | 348.77 |
AlogP | 3.01 |
Hydrogen Bond Acceptor | 7.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 5.0 |
Polar Surface Area | 104.3 |
Molecular species | NEUTRAL |
Aromatic Rings | 3.0 |
Heavy Atoms | 24.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase JakA family
|
- | 1360 | - | - | - | |
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase JakB family
|
- | 1360 | - | - | - | |
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase Trk family
|
- | 3 | - | - | - | |
Transcription factor
|
- | 23-80 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Neoplasms | 1 | D009369 | ClinicalTrials |
Thrombocythemia, Essential | 1 | D013920 | ClinicalTrials |
Primary Myelofibrosis | 1 | D055728 | ClinicalTrials |
Carcinoma, Non-Small-Cell Lung | 1 | D002289 | ClinicalTrials |
Stomach Neoplasms | 1 | D013274 | ClinicalTrials |
Resources | Reference |
---|---|
ChEMBL | CHEMBL1231124 |
DrugBank | DB12588 |
EPA CompTox | DTXSID50239469 |
FDA SRS | KL2Z2TLF01 |
Guide to Pharmacology | 5933 |
PDB | AZ5 |
PubChem | 16659841 |
SureChEMBL | SCHEMBL3345019 |
ZINC | ZINC000058631551 |