PDB ligand accession: 3OJ
DrugBank: DB16039
PubChem:
ChEMBL:
InChI Key: UBMGTTRDNUKZMT-UHFFFAOYSA-N
SMILES: B1(c2ccc(cc2CO1)Oc3ccc(c(c3)C#N)C#N)O
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3O0J | Download | Experimental | e3o0jA1 | PDEase-like | LigPlot |