PDB ligand accession: BK4
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: YTSDNPLOCDVGNB-UHFFFAOYSA-N
SMILES: CC(C)n1c2c(c(n1)c3ccc4cc(ccc4c3)OC)c(ncn2)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3T3V | Download | Experimental | e3t3vA7 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |