Ligand name: (3R,4S)-1-[(4-AMINO-5H-PYRROLO[3,2-D]PYRIMIDIN-7-YL)METHYL]-4-[(METHYLSULFANYL)METHYL]PYRROLIDIN-3-OL
PDB ligand accession: TDI
DrugBank: DB08606
PubChem: 656970
ChEMBL: CHEMBL405346
InChI Key: NTHMDFGHOCNNOE-ZJUUUORDSA-N
SMILES: CSCC1CN(CC1O)Cc2c[nH]c3c2ncnc3N

ClassyFire chemical classification:

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

List of proteins that are targets for TDI

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	A5F5R2_TDI	A5F5R2	n/a
2	E8NLP5_TDI	E8NLP5	n/a
3	A0A1E7P7U4_TDI	A0A1E7P7U4	n/a
4	Q9ZMY2_TDI	Q9ZMY2	n/a
5	Q13126_TDI	Q13126	n/a	Ki(nM) = 0.078 Kd(nM) = 0.034
6	P24247_TDI	P24247	n/a