PDB ligand accession: H5K
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CACMTVGXYAZZNY-UHFFFAOYSA-N
SMILES: c1cc(cc2c1cc(cc2)NC(=O)Nc3cnc(cn3)C#N)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: Naphthalenecarboxylic acids and derivatives
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4FTA | Download | Experimental | e4ftaA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |