PDB ligand accession: NHI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PZRUXYWYONKHDD-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)O)Nc2ccnc(n2)Nc3ccc(cc3)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4DEA | Download | Experimental | e4deaA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |