PDB ligand accession: PP1
DrugBank: DB01809
PubChem:
ChEMBL:
InChI Key: ZVPDNRVYHLRXLX-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)c2c3c(ncnc3n(n2)C(C)(C)C)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 |
---|---|---|---|---|---|
2IVV | Download | Experimental | e2ivvA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
5FM3 | Download | Experimental | e5fm3A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
5FM2 | Download | Experimental | e5fm2A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |