Ligand name: 1-(6-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}-1,3-benzothiazol-2-yl)-3-[2-(morpholin-4-yl)ethyl]urea
PDB ligand accession: 63K
DrugBank: DB15382
PubChem: 25182860
ChEMBL: CHEMBL4461070
InChI Key: ODIUNTQOXRXOIV-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2ccc3nnc(n3n2)Sc4ccc5c(c4)sc(n5)NC(=O)NCCN6CCOCC6)F
Drug action: inhibitor

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P08581

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5HOA	Download	Experimental	e5hoaA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
5HOR	Download	Experimental	e5horA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
5HO6	Download	Experimental	e5ho6A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot