PDB ligand accession: M3A
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: CYMJSSGSRPDYFG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)NC(=O)n2c(nc(n2)Nc3ccc(cc3)C#N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: N-phenylureas
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6OAV | Download | Experimental | e6oavA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |