PDB ligand accession: 353
DrugBank: DB12064
PubChem:
ChEMBL:
InChI Key: VNBRGSXVFBYQNN-UHFFFAOYSA-N
SMILES: CCOC1=C(C(=O)N(C=C1)c2ccc(cc2)F)C(=O)Nc3ccc(c(c3)F)Oc4ccnc(c4Cl)N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3F82 | Download | Experimental | e3f82A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6SDD | Download | Experimental | e6sddA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |