Trade Names | |
Synonyms | |
Status | |
Molecule Category | Free-form |
ATC | L01EF01 |
UNII | G9ZF61LE7G |
InChI Key | AHJRHEGDXFFMBM-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C24H29N7O2 | |
Molecular Weight | 447.54 | |
AlogP | 2.97 | |
Hydrogen Bond Acceptor | 9.0 | |
Hydrogen Bond Donor | 2.0 | |
Number of Rotational Bond | 5.0 | |
Polar Surface Area | 105.04 | |
Molecular species | BASE | |
Aromatic Rings | 3.0 | |
Heavy Atoms | 33.0 |
Mechanism of Action | Action | Reference | |
---|---|---|---|
CDK6/cyclin D1 inhibitor | INHIBITOR | FDA |
Protein: Cyclin-dependent kinase 4/cyclin D1 Description: Cyclin-dependent kinase 4 Organism : Homo sapiens P11802 ENSG00000135446 |
||||
Protein: CDK6/cyclin D1 Description: G1/S-specific cyclin-D1 Organism : Homo sapiens P24385 ENSG00000110092 |
||||
Protein: Cyclin-dependent kinase 4/cyclin D1 Description: G1/S-specific cyclin-D1 Organism : Homo sapiens P24385 ENSG00000110092 |
||||
Protein: CDK6/cyclin D1 Description: Cyclin-dependent kinase 6 Organism : Homo sapiens Q00534 ENSG00000105810 |
||||
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | ||
---|---|---|---|---|---|---|---|
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDC2 subfamily
|
- | 230-8750 | - | - | 42 | ||
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDK9 subfamily
|
- | 1100-1917 | - | 364 | |||
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
|
- | 2-32 | - | 27 | |||
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase JakA family
|
- | 63 | - | - | - | ||
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase JakB family
|
- | 63 | - | - | - | ||
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase PDGFR family
|
- | 3480 | - | - | - | ||
Enzyme
Kinase
Protein kinase regulatory subunit
|
- | 1207 | - | - | - | ||
Other cytosolic protein
|
- | 2-32 | - | 27 |
Resources | Reference | |
---|---|---|
ChEBI | 85993 | |
ChEMBL | CHEMBL189963 | |
DrugBank | DB09073 | |
DrugCentral | 4941 | |
FDA SRS | G9ZF61LE7G | |
Guide to Pharmacology | 7380 | |
PDB | LQQ | |
PharmGKB | PA166153469 | |
PubChem | 5330286 | |
SureChEMBL | SCHEMBL462630 | |
ZINC | ZINC000003938686 |