PDB ligand accession: DTJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SXPUZMXHGHCZEG-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(cc1)C(=O)Nc2cccc(c2CO)C3=NN(C(=O)C(=C3)Nc4ccc(cn4)C(=O)N5CCOCC5)C
Drug action: n/a
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 |
---|---|---|---|---|---|
6BIK | Download | Experimental | e6bikA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |