PDB ligand accession: 2C5
DrugBank: DB06953
InChI Key: JVWHVGIRXILXMU-XMMPIXPASA-N
SMILES: Cn1cncc1C(c2ccc(cc2)C#N)OCc3c(cc(c(n3)Cl)C#N)c4cccc(c4)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P49356 | Download | Predicted | P49356_F1_nD1 | Repetitive alpha hairpins |
1JCQ | Predicted | e1jcqB1 | ||
1LD7 | Predicted | e1ld7B1 | ||
1LD8 | Predicted | e1ld8B1 | ||
1MZC | Predicted | e1mzcB1 | ||
1S63 | Predicted | e1s63B1 | ||
1SA4 | Predicted | e1sa4B1 | ||
1TN6 | Predicted | e1tn6B1 | ||
2F0Y | Predicted | e2f0yB1 | ||
2H6F | Predicted | e2h6fB1 | ||
2H6G | Predicted | e2h6gB1 | ||
2H6H | Predicted | e2h6hB1 | ||
2H6I | Predicted | e2h6iB1 | ||
2IEJ | Predicted | e2iejB1 | ||
3E37 | Predicted | e3e37B1 |