Ligand name: N-{3-[4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydropyrrolo[1,2-b]pyridazin-3-yl]-1,1-dioxido-2H-1,2,4-benzothiadiazin-7 -yl}methanesulfonamide
PDB ligand accession: 3MS
DrugBank: DB07062
PubChem: n/a
ChEMBL: CHEMBL401974
InChI Key: FTVCONULIKITPZ-UHFFFAOYSA-N
SMILES: CC(C)CCN1C(=O)C(=C(c2n1ccc2)O)C3=Nc4ccc(cc4S(=O)(=O)N3)NS(=O)(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thiadiazines
      • Subclass: Benzothiadiazines

List of PDB structures and/or AlphaFold models with target protein P26663

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3CO9	Download	Experimental	e3co9A1 e3co9A2 e3co9B1 e3co9B2	helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits	LigPlot