PDB ligand accession: VEH
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SMMGDTUHUMCVSB-SFHVURJKSA-N
SMILES: Cc1c(sc(n1)Nc2cccc(n2)C(=O)NCCCN(C)C)c3cc4c(c(c3)S(=O)(=O)NC)C(=O)N(C4)C(C)C5CC5
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 |
---|---|---|---|---|---|
7OIJ | Download | Experimental | e7oijAAA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |