PDB ligand accession: 5RV
DrugBank: n/a
PubChem: 118988415;135567098;
ChEMBL:
InChI Key: UBLPQTIVHIXXSM-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)CSc2[nH]c3c(n2)C(=O)N=C(N3)N)C#N
Drug action: n/a
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 |
---|---|---|---|---|---|
5ETL | Download | Experimental | e5etlA1 e5etlB1 e5etlC1 e5etlD1 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |