PDB ligand accession: OAV
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ABKHTUJKHPJZLS-UHFFFAOYSA-N
SMILES: CCN(CCn1cccn1)C(=O)Cc2ccc(cc2)Oc3ccc(c(c3)C)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylethers
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6PIQ | Download | Experimental | e6piqA1 e6piqB2 | Thioredoxin-like Thioredoxin-like | LigPlot |
6PDH | Download | Experimental | e6pdhA1 e6pdhB1 e6pdhB2 | Thioredoxin-like Thioredoxin-like Insertion subdomain in DsbA-like | LigPlot |