Ligand name: 6-ethyl-5-[(3~{S})-3-(6-pyridin-4-yl-1,3-benzodioxol-4-yl)but-1-ynyl]pyrimidine-2,4-diamine
PDB ligand accession: 5N1
DrugBank: n/a
PubChem: 119025601
ChEMBL: n/a
InChI Key: NRVDPWMGAWNSHR-ZDUSSCGKSA-N
SMILES: CCc1c(c(nc(n1)N)N)C#CC(C)c2cc(cc3c2OCO3)c4ccncc4

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Phenylpyridines

List of proteins that are targets for 5N1

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	A4GRC7_5N1	A4GRC7	n/a