PDB ligand accession: D94
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: PDJARQSWGDDFHH-PSWAGMNNSA-N
SMILES: CN1CCN(CC1)C2CC(C2)c3nc(c4n3ccnc4N)c5ccc6ccc(nc6c5)c7ccccc7
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Phenylquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3D94 | Download | Experimental | e3d94A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |