PDB ligand accession: G5X
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SXXLXIJRUAJXGS-UHFFFAOYSA-N
SMILES: c1cc2c(cc1C#CC3(CCCCC3)O)n(cc2C(=O)N)c4ccnc(n4)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolecarboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7CMB | Download | Experimental | e7cmbA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |