Ligand name: 2-({6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl}methyl)benzonitrile
PDB ligand accession: T22
DrugBank: DB06203
PubChem: 11450633
ChEMBL: CHEMBL376359
InChI Key: ZSBOMTDTBDDKMP-OAHLLOKOSA-N
SMILES: CN1C(=O)C=C(N(C1=O)Cc2ccccc2C#N)N3CCCC(C3)N

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzonitriles

List of proteins that are targets for T22

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P27487_T22	P27487	inhibitor	IC50(nM) = 0.9 Kd(nM) = 2.4