PDB ligand accession: P91
DrugBank: DB08365
PubChem:
ChEMBL: n/a
InChI Key: XUAHLMVOYLUYSB-UHFFFAOYSA-N
SMILES: Cn1c2cc(c3c(c2c(c1C(=O)NCCO)Br)C(=O)NC3=O)c4ccccc4Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Pyrroloindoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3CQE | Download | Experimental | e3cqeA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |