Ligand name: FR117016
PDB ligand accession: FR0
DrugBank: DB02616
InChI Key: CKJGKHXCUDWFDC-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)[nH]c(n2)NCc3ccc(s3)c4csc(n4)N=C(N)N
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzimidazoles
      • Subclass: None

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