PDB ligand accession: 4YS
DrugBank: n/a
PubChem: 10284;5280918;
ChEMBL:
InChI Key: VDBNYAPERZTOOF-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C=CNC2=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 |
---|---|---|---|---|---|
5C87 | Download | Experimental | e5c87A1 | Bromodomain-like | LigPlot |