PDB ligand accession: CMG
DrugBank: DB02407
PubChem:
ChEMBL:
InChI Key: MWGXGTJJAOZBNW-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)c(nc(n2)N)OCC3CCCCC3
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Imidazopyrimidines
- Subclass: Purines and purine derivatives
- Class: Imidazopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1H1P | Download | Experimental | e1h1pA1 e1h1pC1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
1E1V | Download | Experimental | e1e1vA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |