Ligand name: 5-[(3-{[(4R)-6,8-dibromo-3,4-dihydro-2H-1-benzopyran-4-yl]amino}propyl)amino]thieno[3,2-b]pyridin-7(6H)-one
PDB ligand accession: U81
DrugBank: DB12262
PubChem: 16744283
ChEMBL: CHEMBL4297370
InChI Key: NNTYBKTXMKBRFA-CQSZACIVSA-N
SMILES: c1csc2c1NC(=CC2=O)NCCCNC3CCOc4c3cc(cc4Br)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzopyrans
      • Subclass: 1-benzopyrans

List of PDB structures and/or AlphaFold models with target protein Q8PMP0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6WQT	Download	Experimental	e6wqtA1 e6wqtA2	HUP domain-like Rubredoxin-like	LigPlot