Ligand name: 2-(5-Hydroxy-4-(isoindoline-2-carbonyl)-2-isopropylphenyl)acetonitrile
PDB ligand accession: 871
DrugBank: n/a
PubChem: 131955111
ChEMBL: n/a
InChI Key: BZEHHGZKLNMDRW-UHFFFAOYSA-N
SMILES: CC(C)c1cc(c(cc1CC#N)O)C(=O)N2Cc3ccccc3C2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P08238

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5UCH	Download	Experimental	e5uchA1 e5uchB1 e5uchC1 e5uchD1	ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like	LigPlot