PDB ligand accession: SKK
DrugBank: DB12417
PubChem:
ChEMBL:
InChI Key: LDXYBEHACFJIEL-HNNXBMFYSA-N
SMILES: Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N3CCCC3C#N
Drug action: modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3WQH | Download | Experimental | e3wqhA1 e3wqhA2 e3wqhB2 e3wqhB3 | beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases | LigPlot |