Ligand name: methyl 2-[[6-[[3,4-bis(fluoranyl)phenyl]amino]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanoate
PDB ligand accession: LWN
DrugBank: n/a
PubChem: 134158339
ChEMBL: CHEMBL3988766
InChI Key: IIDIQDPMMHWKNL-UHFFFAOYSA-N
SMILES: Cn1c2c(cn1)c(nc(n2)Nc3ccc(c(c3)F)F)NCC(=O)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q4QCD2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6SWX	Download	Experimental	e6swxA1	HUP domain-like	LigPlot