Ligand name: N-(pyridin-4-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine
PDB ligand accession: F91
DrugBank: n/a
PubChem: 961305
ChEMBL: CHEMBL1533396
InChI Key: ZEHRBOVXNPCYAK-UHFFFAOYSA-N
SMILES: c1cc2c(cc1NCc3ccncc3)OCCO2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodioxanes
      • Subclass: Benzo-1,4-dioxanes

List of PDB structures and/or AlphaFold models with target protein P11838

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4Y45	Download	Experimental	e4y45A1 e4y45A2	cradle loop barrel cradle loop barrel	LigPlot
3PI0	Download	Experimental	e3pi0A2 e3pi0A3	cradle loop barrel cradle loop barrel	LigPlot
5MB0	Download	Experimental	e5mb0A1 e5mb0A2	cradle loop barrel cradle loop barrel	LigPlot