PDB ligand accession: LS3
DrugBank: DB08124
PubChem:
ChEMBL:
InChI Key: FTQYGMLRLRXBPT-IDUWFGFVSA-N
SMILES: c1cc2c(cc1c3cnco3)C(=CNc4ccc5c(c4)CS(=O)(=O)C5)C(=O)N2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolines
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1KE7 | Download | Experimental | e1ke7A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |