PDB ligand accession: ROL
DrugBank: DB04149
PubChem:
ChEMBL:
InChI Key: HJORMJIFDVBMOB-LBPRGKRZSA-N
SMILES: COc1ccc(cc1OC2CCCC2)C3CC(=O)NC3
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrrolidines
- Subclass: Phenylpyrrolidines
- Class: Pyrrolidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1XN0 | Download | Experimental | e1xn0A1 e1xn0B1 | PDEase-like PDEase-like | LigPlot |
1RO6 | Download | Experimental | e1ro6A1 e1ro6B1 | PDEase-like PDEase-like | LigPlot |
1XMY | Download | Experimental | e1xmyA1 e1xmyB1 | PDEase-like PDEase-like | LigPlot |
4X0F | Download | Experimental | e4x0fA1 e4x0fB2 e4x0fA2 e4x0fB1 | PDEase-like Phosphodiesterase 4 upstream conserved regions (UCR) Phosphodiesterase 4 upstream conserved regions (UCR) PDEase-like | LigPlot |