PDB ligand accession: 1OI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: HTTRFYNWHOXUPE-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1)-c3ccsc3NC2=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: Isoquinolones and derivatives
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7OUW | Download | Experimental | e7ouwA1 | ADP-ribosylation | LigPlot |