Ligand name: 1-[1-(3-aminophenyl)-3-tert-butyl-1H-pyrazol-5-yl]-3-naphthalen-1-ylurea
PDB ligand accession: 1AU
DrugBank: DB06882
PubChem: 25174101
ChEMBL: CHEMBL522387
InChI Key: HJWMLCDGRWWLAQ-UHFFFAOYSA-N
SMILES: CC(C)(C)c1cc(n(n1)c2cccc(c2)N)NC(=O)Nc3cccc4c3cccc4
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HV7	Download	Experimental	e3hv7A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot