PDB ligand accession: 3J7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PTOPXBFSXASLNA-UHFFFAOYSA-N
SMILES: CC(C)(CNc1c2ccncc2nc(n1)c3ccc4c(c3)cn[nH]4)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridopyrimidines
- Subclass: Pyrido[3,4-d]pyrimidines
- Class: Pyridopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4W7P | Download | Experimental | e4w7pA1 e4w7pB1 e4w7pC1 e4w7pD1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |