PDB ligand accession: 3E8
DrugBank: DB15133
InChI Key: AHYMHWXQRWRBKT-UHFFFAOYSA-N
SMILES: CN1CCC(CC1)COc2cnc(nc2)c3cccc(c3)CN4C(=O)C=CC(=N4)c5cccc(c5)C#N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyridazines and derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P49286 | Download | Predicted | P49286_F1_nD1 | Family A G protein-coupled receptor-like |
6ME6 | Predicted | e6me6A2 e6me6B2 | ||
6ME7 | Predicted | e6me7B2 | ||
6ME8 | Predicted | e6me8A2 e6me8B1 | ||
6ME9 | Predicted | e6me9B2 |