PDB ligand accession: L1X
DrugBank: DB12381
PubChem:
ChEMBL:
InChI Key: QHADVLVFMKEIIP-UHFFFAOYSA-N
SMILES: CC1=CC=C(C(=O)N1c2ccc(cc2)F)C(=O)Nc3ccc(c(c3)F)Oc4cc5cnn(c5cc4c6c[nH]nc6)C
Drug action: modulator
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 |
---|---|---|---|---|---|
4EEV | Download | Experimental | e4eevA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |