PDB ligand accession: P63
DrugBank: DB08362
PubChem:
ChEMBL:
InChI Key: QVKXQLGRDOMAGC-UHFFFAOYSA-N
SMILES: CC(=O)Nc1cccc(c1)Nc2nc3c(cnn3c(n2)Nc4ccccc4)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2PVN | Download | Experimental | e2pvnA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |