Ligand name: 2-(2-{[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]amino}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
PDB ligand accession: NF1
DrugBank: n/a
PubChem: 86223063
ChEMBL: CHEMBL4592668
InChI Key: YHPDOCZSFWEMOD-UHFFFAOYSA-N
SMILES: Cc1nnc(s1)CNCCN2C(=O)c3cccc4c3c(ccc4)C2=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: Isoquinolones and derivatives

List of PDB structures and/or AlphaFold models with target protein Q06GJ0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3WMB	Download	Experimental	e3wmbA2	TIM beta/alpha-barrel	LigPlot