PDB ligand accession: 2PU
DrugBank: DB06976
PubChem:
ChEMBL:
InChI Key: IWOOJEZSDPRYAZ-WFASDCNBSA-N
SMILES: c1cc2c(c(c1)NC(=O)Nc3cc([nH]n3)C4CCCN4)C5CCCN5C2=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoindoles and derivatives
- Subclass: Isoindolines
- Class: Isoindoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1GIJ | Download | Experimental | e1gijA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |