PDB ligand accession: 4EK
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RKERQEKFTWWCEY-GOSISDBHSA-N
SMILES: c1ccnc(c1)c2cnc3n2nc(cc3)N4CCCC4c5cccc(c5)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrrolidines
- Subclass: Phenylpyrrolidines
- Class: Pyrrolidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YNE | Download | Experimental | e4yneA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |