PDB ligand accession: ABJ
DrugBank: DB07335
PubChem:
ChEMBL:
InChI Key: MWYBBCLGEHZSCP-UHFFFAOYSA-N
SMILES: CC(C)n1c2c(c(n1)c3cccc(c3)O)c(ncn2)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3EN7 | Download | Experimental | e3en7A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |