Ligand name: N-(isoquinolin-4-yl)-2-phenylacetamide
PDB ligand accession: QF5
DrugBank: n/a
PubChem: 156906707
ChEMBL: n/a
InChI Key: IBEFUXAVGLACIF-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CC(=O)Nc2cncc3c2cccc3
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 P0DTD1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7GID	Download	Experimental	e7gidA1 e7gidA2 e7gidB1 e7gidA1 e7gidB1 e7gidB2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot