Ligand name: 5-methyl-2-(2-propan-2-ylphenyl)-~{N}-[[4-(1,2,3-triazol-1-yl)phenyl]methyl]pyrimidin-4-amine
PDB ligand accession: JDA
DrugBank: n/a
PubChem: 60167849
ChEMBL: CHEMBL3182437
InChI Key: VUIRVWPJNKZOSS-UHFFFAOYSA-N
SMILES: Cc1cnc(nc1NCc2ccc(cc2)n3ccnn3)c4ccccc4C(C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Triazoles

List of PDB structures and/or AlphaFold models with target protein O94782

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8A9K	Download	Experimental	e8a9kD1	Cysteine proteinases-like	LigPlot
7ZH4	Download	Experimental	e7zh4D1	Cysteine proteinases-like	LigPlot