PDB ligand accession: 2V2
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MCCQXDYJMDEUOT-UHFFFAOYSA-N
SMILES: Cc1c(cccc1N2C=Nc3cc(ccc3C2=O)C(C)(C)C)C4=CN(C(=O)C(=C4)NC(=O)NC)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4OTQ | Download | Experimental | e4otqA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |