Ligand name: 4-(4-{1-[(6-aminopyridin-2-yl)methyl]-5-(2-chlorophenyl)-1H-pyrrol-2-yl}phenoxy)butanenitrile
PDB ligand accession: 625
DrugBank: n/a
PubChem: 11719190
ChEMBL: CHEMBL1089137
InChI Key: CERJQPWNRISSQS-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)c2ccc(n2Cc3cccc(n3)N)c4ccc(cc4)OCCCC#N)Cl
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 P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3L3A	Download	Experimental	e3l3aA2 e3l3aA3	cradle loop barrel cradle loop barrel	LigPlot