PDB ligand accession: NEO
DrugBank: DB02385
PubChem: 444632;5289005;135460965;
ChEMBL: n/a
InChI Key: BMQYVXCPAOLZOK-INEUFUBQSA-N
SMILES: c1c(nc2c(n1)N=C(NC2=O)N)C(C(CO)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pteridines and derivatives
- Subclass: Pterins and derivatives
- Class: Pteridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1BR5 | Download | Experimental | e1br5A1 | RIP/Polo-box domain | LigPlot |