Ligand name: 2-(2,4-dimethoxyphenyl)-1-{4-[(isoquinolin-5-yl)sulfonyl]piperazin-1-yl}ethan-1-one
PDB ligand accession: FWP
DrugBank: n/a
PubChem: 138105928
ChEMBL: CHEMBL4467164
InChI Key: MEHDVSZDAVOOKI-UHFFFAOYSA-N
SMILES: COc1ccc(c(c1)OC)CC(=O)N2CCN(CC2)S(=O)(=O)c3cccc4c3ccnc4
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 G7CNL4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6D4U	Download	Experimental	e6d4uA1	TIM beta/alpha-barrel	LigPlot