Ligand name: N-[3-(4-amino-3-methylphenyl)-1H-pyrazol-5-yl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide
PDB ligand accession: 45Q
DrugBank: n/a
PubChem: 119025618
ChEMBL: CHEMBL3809012
InChI Key: BUBLMWQDUODHGD-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1N)c2cc([nH]n2)NC(=O)c3ccc(cc3)CN4CCN(CC4)C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9UM73

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5IUI	Download	Experimental	e5iuiA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot