PDB ligand accession: BRY
DrugBank: DB07493
PubChem:
ChEMBL:
InChI Key: IEQQJQHHJMQETK-YPKPFQOOSA-N
SMILES: c1ccc2c(c1)C(=O)C(=C3c4cc(ccc4NC3=O)Br)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 |
---|---|---|---|---|---|
2BHE | Download | Experimental | e2bheA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |