PDB ligand accession: UO5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CDIPSADLEIZARJ-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)CCN(CC2)C(=O)CN3Cc4ccc(cc4C3=O)c5c(cnc(n5)NC6CCOCC6)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzazepines
- Subclass: None
- Class: Benzazepines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7NR3 | Download | Experimental | e7nr3A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |