Ligand name: alisertib
PDB ligand accession: A5B
DrugBank: DB05220
PubChem: 24771867
ChEMBL: CHEMBL483158
InChI Key: ZLHFILGSQDJULK-UHFFFAOYSA-N
SMILES: COc1cccc(c1C2=NCc3cnc(nc3-c4c2cc(cc4)Cl)Nc5ccc(c(c5)OC)C(=O)O)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzazepines
      • Subclass: None

List of proteins that are targets for DB05220

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P29317_A5B	P29317	n/a
2	O14965_A5B	O14965	inhibitor