PDB ligand accession: INE
DrugBank: DB01997
InChI Key: NFSTZPMYAZRZPC-UHFFFAOYSA-N
SMILES: c1cc2c(c(c1)[N+](=O)[O-])[nH]nc2Br
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P35228 | Download | Predicted | P35228_F1_nD1 | Nitric oxide (NO) synthase oxygenase domain |
1NSI | Predicted | e1nsiC1 e1nsiB1 e1nsiD1 e1nsiA1 | ||
2NSI | Predicted | e2nsiA1 e2nsiD1 e2nsiC1 e2nsiB1 | ||
3E7G | Predicted | e3e7gB1 e3e7gD1 e3e7gA1 e3e7gC1 | ||
3EJ8 | Predicted | e3ej8A1 e3ej8B1 e3ej8C1 e3ej8D1 | ||
3HR4 | Predicted | e3hr4A1 e3hr4E2 e3hr4C2 e3hr4G2 | ||
4CX7 | Predicted | e4cx7A1 e4cx7B1 e4cx7C1 e4cx7D1 | ||
4NOS | Predicted | e4nosB1 e4nosA1 e4nosC1 e4nosD1 |