Ligand name: FR221647
PDB ligand accession: FR2
DrugBank: DB02096
InChI Key: ZUYUIKKHHBEVHL-GFCCVEGCSA-N
SMILES: c1ccc(cc1)CCC(CO)n2cc(nc2)C(=O)N
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Carboxylic acid derivatives

List of PDB structures and/or AlphaFold models with target protein P00813

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
P00813	Download	Predicted	P00813_F1_nD1	TIM beta/alpha-barrel
3IAR		Predicted	e3iarA1