Ligand name: 2-[(4-ethynyl-2-fluorophenyl)amino]-3,4-difluoro-N-(2-hydroxyethoxy)-5-{[(2-hydroxyethoxy)imino]methyl}benzamide
PDB ligand accession: 3OS
DrugBank: n/a
PubChem: 11430524
ChEMBL: CHEMBL1684486
InChI Key: NLXYHBBGDADWQY-BHGWPJFGSA-N
SMILES: C#Cc1ccc(c(c1)F)Nc2c(cc(c(c2F)F)C=NOCCO)C(=O)NOCCO
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 Q02750

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3OS3	Download	Experimental	e3os3A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot