Ligand name: (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(butylsulfanyl)methyl]pyrrolidin-3-ol
PDB ligand accession: BIG
DrugBank: DB07463
PubChem: 11393519
ChEMBL: CHEMBL1231347
InChI Key: LTSUEVPGSXUJHT-OLZOCXBDSA-N
SMILES: CCCCSCC1CN(CC1O)Cc2c[nH]c3c2ncnc3N

ClassyFire chemical classification:

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

List of proteins that are targets for BIG

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	A7ZHQ1_BIG	A7ZHQ1	n/a
2	E8NLP5_BIG	E8NLP5	n/a
3	Q9ZMY2_BIG	Q9ZMY2	n/a	Kd(nM) = 50.0
4	Q9KPI8_BIG	Q9KPI8	n/a
5	Q13126_BIG	Q13126	n/a
6	A0A1E7P7U4_BIG	A0A1E7P7U4	n/a