PDB ligand accession: KZQ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: HEAIGWIZTYAQTC-KRWDZBQOSA-N
SMILES: CC1=C(C(NC(=O)N1)c2ccc(cc2)F)C(=O)Nc3ccc4c(c3)c[nH]n4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4PNK | Download | Experimental | e4pnkA3 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |