PDB ligand accession: HA1
DrugBank: DB04260
PubChem: 448999;5288506;135460987;
ChEMBL:
InChI Key: JANQQPWTLXUSCD-UHFFFAOYSA-N
SMILES: c1nc2c(n1CCCCC(F)(F)P(=O)(O)O)N=C(NC2=O)N
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Imidazopyrimidines
- Subclass: Purines and purine derivatives
- Class: Imidazopyrimidines
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P55859_HA1 | P55859 | n/a | Ki(nM) = 2.7 IC50(nM) = 18.7 Kd(nM) = 0.46 |
2 | P00491_HA1 | P00491 | inhibitor | Ki(nM) = 10.8 IC50(nM) = 20.2 |