Ligand name: 4-[(5-{[4-(3-CHLOROPHENYL)-3-OXOPIPERAZIN-1-YL]METHYL}-1H-IMIDAZOL-1-YL)METHYL]BENZONITRILE
PDB ligand accession: 778
DrugBank: DB07227
PubChem: 216454
ChEMBL: CHEMBL279433
InChI Key: JNUGFGAVPBYSHF-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)Cl)N2CCN(CC2=O)Cc3cncn3Cc4ccc(cc4)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P53610

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1S64	Download	Experimental	e1s64B1 e1s64A1 e1s64D1 e1s64C1 e1s64F1 e1s64E1 e1s64H1 e1s64G1 e1s64J1 e1s64I1 e1s64L1 e1s64K1	Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot