PDB ligand accession: MWV
DrugBank: DB01388
PubChem:
ChEMBL:
InChI Key: HBNPJJILLOYFJU-VMPREFPWSA-N
SMILES: CC(C)C1c2ccc(cc2CCC1(CCN(C)CCCc3[nH]c4ccccc4n3)OC(=O)COC)F
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Tetralins
- Subclass: None
- Class: Tetralins
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P54284_MWV | P54284 | inhibitor | |
2 | O00305_MWV | O00305 | inhibitor | |
3 | Q08289_MWV | Q08289 | inhibitor | |
4 | Q9P0X4_MWV | Q9P0X4 | inhibitor | IC50(nM) = 126.0 |
5 | Q01668_MWV | Q01668 | inhibitor | |
6 | O95180_MWV | O95180 | inhibitor | IC50(nM) = 32.0 |
7 | O43497_MWV | O43497 | inhibitor | IC50(nM) = 64.0 |
8 | O60840_MWV | O60840 | inhibitor | |
9 | Q02641_MWV | Q02641 | inhibitor | |
10 | Q13698_MWV | Q13698 | inhibitor | |
11 | Q13936_MWV | Q13936 | inhibitor | IC50(nM) = 156.0 |
12 | P08684_MWV | P08684 | n/a | Ki(nM) = 280.0 IC50(nM) = 130.0 |