Ligand name: N-[3-(4-{[(2-aminoethyl)(methyl)amino]methyl}-1H-pyrrol-3-yl)phenyl]prop-2-enamide
PDB ligand accession: O3P
DrugBank: n/a
PubChem: 138753329
ChEMBL: CHEMBL4463793
InChI Key: HVDMIAFOVVMNJF-UHFFFAOYSA-N
SMILES: CN(CCN)Cc1c[nH]cc1c2cccc(c2)NC(=O)C=C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrroles
      • Subclass: Substituted pyrroles

List of PDB structures and/or AlphaFold models with target protein Q96LA8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6P7I	Download	Experimental	e6p7iA1 e6p7iA2 e6p7iB1 e6p7iB2 e6p7iC1 e6p7iC2	Arginine methyltransferase oligomerization subdomain Rossmann-like Rossmann-like Arginine methyltransferase oligomerization subdomain Arginine methyltransferase oligomerization subdomain Rossmann-like	LigPlot