PDB ligand accession: A0Q
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QGEBKIOJSNPDFE-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)c2ccc(c(c2)C(=O)Nc3cccnc3)OCc4ccccc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5OQ8 | Download | Experimental | e5oq8A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
5OQ7 | Download | Experimental | e5oq7A1 e5oq7B1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
5OP2 | Download | Experimental | e5op2A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |