PDB ligand accession: C07
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZQQZSFIPDUAFMC-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1N2c3c(c(ncn3)N)C4=C(C2=O)CCCC4)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: Isoquinolones and derivatives
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4G2F | Download | Experimental | e4g2fA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |