PDB ligand accession: FO2
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WDLBUONJQGHSKT-UHFFFAOYSA-N
SMILES: CN1CCC(CC1)c2cnn(c2)c3c4c(ccn3)C(=O)NC=N4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyrazolylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6H4Q | Download | Experimental | e6h4qA1 e6h4qB1 e6h4qC1 e6h4qD1 | jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
6H4U | Download | Experimental | e6h4uA1 e6h4uB1 e6h4uC1 e6h4uD1 | jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |