PDB ligand accession: ML8
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LASGWNJRSNLLFV-UHFFFAOYSA-N
SMILES: Cc1c2c(nc(n1)NC)N(C(=O)C(=C2)c3cccc(c3)CO)C4CCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3ML8 | Download | Experimental | e3ml8A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |