PDB ligand accession: 34I
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WNRCGOJLZOLSJN-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)CCC(=O)N2CC(=O)Nc3c(c(cs3)C#N)c4[nH]ncn4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Quinolones and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3RTP | Download | Experimental | e3rtpA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |