PDB ligand accession: 2EA
DrugBank: DB06959
PubChem:
ChEMBL: n/a
InChI Key: BUCZDJYEOAQTHL-KEKNWZKVSA-N
SMILES: c1ccc2c(c1)C(C=N2)CC(COc3cc(cnc3)c4ccc5cnccc5c4)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: None
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2F7E | Download | Experimental | e2f7eE1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |