PDB ligand accession: 3X7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PPYHOOZGDDPLKM-UHFFFAOYSA-N
SMILES: c1cc(ccc1CN2CCCCC2)c3cc4c5cc(ncc5[nH]c4nc3)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: Benzylpiperidines
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4RVM | Download | Experimental | e4rvmA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |