Ligand name: 1-(6-bromo-5-ethoxypyridin-3-yl)-1,4-diazepane
PDB ligand accession: 09S
DrugBank: n/a
PubChem: 10402507
ChEMBL: CHEMBL72433
InChI Key: UGNNTIXQGYYUAP-UHFFFAOYSA-N
SMILES: CCOc1cc(cnc1Br)N2CCCNCC2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

List of PDB structures and/or AlphaFold models with target protein P58154

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3U8N	Download	Experimental	e3u8nA1 e3u8nB1 e3u8nB1 e3u8nC1 e3u8nC1 e3u8nD1 e3u8nD1 e3u8nE1 e3u8nA1 e3u8nE1 e3u8nF1 e3u8nG1 e3u8nG1 e3u8nH1 e3u8nH1 e3u8nI1 e3u8nI1 e3u8nJ1 e3u8nF1 e3u8nJ1 e3u8nK1 e3u8nL1 e3u8nL1 e3u8nM1 e3u8nM1 e3u8nN1 e3u8nN1 e3u8nO1 e3u8nK1 e3u8nO1 e3u8nP1 e3u8nQ1 e3u8nQ1 e3u8nR1 e3u8nR1 e3u8nS1 e3u8nS1 e3u8nT1 e3u8nP1 e3u8nT1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot