PDB ligand accession: CEL
DrugBank: DB00482
PubChem:
ChEMBL:
InChI Key: RZEKVGVHFLEQIL-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5JW1 | Download | Experimental | e5jw1A2 e5jw1B2 | Heme-dependent peroxidases Heme-dependent peroxidases | LigPlot |
3LN1 | Download | Experimental | e3ln1A1 e3ln1B1 e3ln1C1 e3ln1D1 | Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases | LigPlot |