Ligand name: Roniciclib
PDB ligand accession: R0N
DrugBank: DB12974
PubChem: 71494949
ChEMBL: CHEMBL4282338
InChI Key: UELYDGOOJPRWGF-SRQXXRKNSA-N
SMILES: CC(C(C)Oc1c(cnc(n1)Nc2ccc(cc2)S(=N)(=O)C3CC3)C(F)(F)F)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Aniline and substituted anilines

List of PDB structures and/or AlphaFold models with target protein P24941

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5IEV	Download	Experimental	e5ievA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot