PDB ligand accession: NSC
DrugBank: DB04452
PubChem:
ChEMBL:
InChI Key: HOUSDILKOJMENG-UHFFFAOYSA-N
SMILES: Cc1cc(c2cc(ccc2n1)NC(=O)Nc3ccc4c(c3)c(cc(n4)C)N)N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Aminoquinolines and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1PWP | Download | Experimental | e1pwpA3 e1pwpA1 e1pwpB3 | Zincin-like ADP-ribosylation Zincin-like | LigPlot |