PDB ligand accession: EVK
DrugBank: DB13930
PubChem:
ChEMBL:
InChI Key: KSERXGMCDHOLSS-LJQANCHMSA-N
SMILES: CC(C)Nc1cc(c(cn1)Cl)c2cc([nH]c2)C(=O)NC(CO)c3cccc(c3)Cl
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Carboxylic acid derivatives
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6GDQ | Download | Experimental | e6gdqA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |