PDB ligand accession: 3RE
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: UDXSDTPXGCELRI-HAQNSBGRSA-N
SMILES: Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3cc[nH]n3)C4CCC(CC4)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyrazolylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3PRE | Download | Experimental | e3preA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |