PDB ligand accession: 56H
DrugBank: DB05969
InChI Key: OUSFTKFNBAZUKL-UHFFFAOYSA-N
SMILES: CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: Piperidinecarboxylic acids and derivatives
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
|---|---|---|---|---|
| P50613 | Download | Predicted | P50613_F1_nD1 | Protein kinase/SAICAR synthase/ATP-grasp |
| 1UA2 | Predicted | e1ua2C1 e1ua2A1 e1ua2D1 e1ua2B1 | ||
| 6O9L | Predicted | e6o9l81 |