PDB ligand accession: EV1
DrugBank: DB01113
PubChem:
ChEMBL:
InChI Key: XQYZDYMELSJDRZ-UHFFFAOYSA-N
SMILES: COc1ccc(cc1OC)Cc2c3cc(c(cc3ccn2)OC)OC
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: Benzylisoquinolines
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3IAK | Download | Experimental | e3iakA1 | PDEase-like | LigPlot |