PDB ligand accession: OA2
DrugBank: DB08315
PubChem:
ChEMBL:
InChI Key: KIJXWOGFYAWTNC-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CN(Cc2ccccc2)C(=O)c3cnc(o3)N
Drug action: n/a
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 |
---|---|---|---|---|---|
2W6N | Download | Experimental | e2w6nA1 e2w6nA2 e2w6nB1 e2w6nB2 | Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid | LigPlot |