PDB ligand accession: 047
DrugBank: DB06833
PubChem:
ChEMBL:
InChI Key: MMIJMYOYKAKQPN-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)n2cc(c3c2cccc3)CNCC4CCCCC4
Drug action: antagonist
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrroles
- Subclass: Substituted pyrroles
- Class: Pyrroles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2PJL | Download | Experimental | e2pjlA1 e2pjlB1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |