PDB ligand accession: GX3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PUIXMSRTTHLNKI-UHFFFAOYSA-N
SMILES: CNc1ncc2c(n1)N(C(=O)C(=C2)c3c(c(cc(c3Cl)OC)OC)Cl)CCCN4CCN(CC4)C(=O)C=C
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 |
---|---|---|---|---|---|
7F3M | Download | Experimental | e7f3mA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |