Ligand name: (4R,2S)-5'-(4-(4-CHLOROBENZYLOXY)PYRROLIDIN-2-YLMETHANESULFONYL)ISOQUINOLINE
PDB ligand accession: CQP
DrugBank: DB07583
PubChem: 5327110
ChEMBL: n/a
InChI Key: RLNNFNGBXLTQOB-RBUKOAKNSA-N
SMILES: c1cc2cnccc2c(c1)S(=O)(=O)NCC3CC(CN3)OCc4ccc(cc4)Cl
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 P00517

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2C1B	Download	Experimental	e2c1bA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot