PDB ligand accession: WJX
DrugBank: DB15444
PubChem:
ChEMBL:
InChI Key: MVRHVFSOIWFBTE-INIZCTEOSA-N
SMILES: Cc1c(cn(n1)C)S(=O)(=O)NC(=O)c2ccc(nc2N3CC(CC3(C)C)C)n4ccc(n4)OCC(C)(C)C(F)(F)F
Drug action: positive allosteric modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyrazolylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8EIG | Download | Experimental | e8eigA3 e8eigA4 | Type II ABC exporter transmembrane domain fold Type II ABC exporter transmembrane domain fold | LigPlot |
8EIO | Download | Experimental | e8eioA2 e8eioA3 | Type II ABC exporter transmembrane domain fold Type II ABC exporter transmembrane domain fold | LigPlot |
8EIQ | Download | Experimental | e8eiqA3 e8eiqA4 | Type II ABC exporter transmembrane domain fold Type II ABC exporter transmembrane domain fold | LigPlot |