PDB ligand accession: 72Q
DrugBank: DB15463
InChI Key: LOMMPXLFBTZENJ-ZACQAIPSSA-N
SMILES: CS(=O)(=O)c1ccc(c2c1C(C(C2F)F)O)Oc3cc(cc(c3)F)C#N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q99814 | Download | Predicted | Q99814_F1_nD2 Q99814_F1_nD3 Q99814_F1_nD1 | Profilin-like Profilin-like HLH-like |
1P97 | Predicted | e1p97A1 | ||
2A24 | Predicted | e2a24A1 | ||
3F1N | Predicted | e3f1nA1 | ||
3F1O | Predicted | e3f1oA1 | ||
3F1P | Predicted | e3f1pA1 | ||
3H7W | Predicted | e3h7wA1 | ||
3H82 | Predicted | e3h82A1 | ||
4GHI | Predicted | e4ghiA1 | ||
4GS9 | Predicted | e4gs9A1 | ||
4PKY | Predicted | e4pkyG1 | ||
4XT2 | Predicted | e4xt2C1 e4xt2A1 | ||
5KIZ | Predicted | e5kizA1 | ||
5TBM | Predicted | e5tbmA1 | ||
5UFP | Predicted | e5ufpA1 | ||
6CZW | Predicted | e6czwA1 | ||
6D09 | Predicted | e6d09A1 | ||
6D0B | Predicted | e6d0bA1 | ||
6D0C | Predicted | e6d0cA1 |