Ligand name: 5-[[(2~{S})-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline
PDB ligand accession: 9K6
DrugBank: n/a
PubChem: 42610506
ChEMBL: n/a
InChI Key: DSOQHHGSXZTTAQ-LBPRGKRZSA-N
SMILES: CC1CNCCCN1S(=O)(=O)c2cccc3c2ccnc3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: None

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
5M75	Download	Experimental	e5m75A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot