Ligand name: 3-[(2-{[1-(N,N-dimethylglycyl)-6-methoxy-4,4-dimethyl-1,2,3,4-tetrahydroquinolin-7-yl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]thiophene-2-carboxamide
PDB ligand accession: KQQ
DrugBank: n/a
PubChem: 25210972
ChEMBL: CHEMBL463931
InChI Key: YNSCKPCDFIDINW-UHFFFAOYSA-N
SMILES: CC1(CCN(c2c1cc(c(c2)Nc3nc4c(cc[nH]4)c(n3)Nc5ccsc5C(=O)N)OC)C(=O)CN(C)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Hydroquinolines

List of PDB structures and/or AlphaFold models with target protein P28327

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4PNI	Download	Experimental	e4pniA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot