PDB ligand accession: 5SF
DrugBank: DB12147
InChI Key: OLAHOMJCDNXHFI-UHFFFAOYSA-N
SMILES: CC(C)NCCN(c1ccc2c(c1)nc(cn2)c3cnn(c3)C)c4cc(cc(c4)OC)OC
Drug action: substrate
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P16234 | Download | Predicted | P16234_F1_nD3 P16234_F1_nD5 | Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp |
5GRN | Predicted | e5grnA1 | ||
5K5X | Predicted | e5k5xA1 | ||
6A32 | Predicted | e6a32A1 |