PDB ligand accession: Z6V
DrugBank: DB17520
PubChem:
ChEMBL:
InChI Key: TVGAHWWPABTBCX-UHFFFAOYSA-N
SMILES: Cc1c(ccc(n1)C2=CN=C(N(C2=O)C)NC(C)C)Oc3ccnc(c3)c4cnn(c4)C
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyrazolylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7MFC | Download | Experimental | e7mfcA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |