Ligand name: 4-[(1-{(1S,2S)-1-[1-(4-aminobutyl)-1H-1,2,3-triazol-4-yl]-2-methylbutyl}-1H-1,2,3-triazol-4-yl)methoxy]-3-methoxybenzene-1-carboximidamide
PDB ligand accession: VN1
DrugBank: n/a
PubChem: 156024955
ChEMBL: n/a
InChI Key: DNIWQYWTKVVYDZ-BTYIYWSLSA-N
SMILES: CCC(C)C(c1cn(nn1)CCCCN)n2cc(nn2)COc3ccc(cc3OC)C(=N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenol ethers
      • Subclass: Anisoles

List of PDB structures and/or AlphaFold models with target protein P00760

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7JWX	Download	Experimental	e7jwxA1 e7jwxC1 e7jwxB1 e7jwxD1	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot