Ligand name: 4-tert-butyl-N-[6-(2-hydroxyethyloxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide
PDB ligand accession: K86
DrugBank: DB00559
PubChem: 104865
ChEMBL: CHEMBL957
InChI Key: GJPICJJJRGTNOD-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc2c(c(nc(n2)c3ncccn3)OCCO)Oc4ccccc4OC

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of proteins that are targets for K86

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P24530_K86	P24530	antagonist	Ki(nM) = 80.0 IC50(nM) = 95.0
2	P25101_K86	P25101	antagonist	Ki(nM) = 6.5 IC50(nM) = 4.7