Ligand name: 3-(1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl)-4-hydroxy-1-(3-methylbutyl)quinolin-2(1H)-one
PDB ligand accession: 888
DrugBank: DB07275
PubChem: 135412361
ChEMBL: CHEMBL176058
InChI Key: MQFPIRFODWNQIO-UHFFFAOYSA-N
SMILES: CC(C)CCN1c2ccccc2C(=C(C1=O)C3=NS(=O)(=O)c4ccccc4N3)O
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 Q99AU2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2FVC	Download	Experimental	e2fvcA1 e2fvcA2 e2fvcB1 e2fvcB2	helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits	LigPlot