PDB ligand accession: 8W7
DrugBank: DB12101
PubChem:
ChEMBL:
InChI Key: IXZOHGPZAQLIBH-NRFANRHFSA-N
SMILES: c1cc2c(c(c1)OCc3ccc(cc3)CN4CCOCC4)CN(C2=O)C5CCC(=O)NC5=O
Drug action: inhibitor
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 |
---|---|---|---|---|---|
8D80 | Download | Experimental | e8d80B1 e8d80B2 e8d80C1 | cradle loop barrel ETN0001 domain-like beta-beta-alpha zinc fingers | LigPlot |
5V3O | Download | Experimental | e5v3oC1 e5v3oC2 | ETN0001 domain-like cradle loop barrel | LigPlot |