Ligand name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinolin-1-amine
PDB ligand accession: LRT
DrugBank: n/a
PubChem: 49870878
ChEMBL: CHEMBL1667963
InChI Key: QITCSTCJTLZZMU-UHFFFAOYSA-N
SMILES: c1cc2c(ccnc2N)c(c1)S(=O)(=O)N3CCCNCC3
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P25321

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6Y2U	Download	Experimental	e6y2uA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
6SQ1	Download	Experimental	e6sq1A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
6YNT	Download	Experimental	e6yntA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot