Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.74 |
| ▸ | PDK1 | Q15118 | 17/20 | 0.69 |
| ▸ | PDK2 | Q15119 | 17/20 | 0.69 |
| ▸ | PDK3 | Q15120 | 17/20 | 0.69 |
| ▸ | PDK4 | Q16654 | 17/20 | 0.69 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.61 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.61 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.60 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5737838 | 0.91 | PDK1 (0.69) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL6568189 | 0.91 | ABCB11 (0.69) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL6568185 | 0.91 | ABCB11 (0.69) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5739088 | 0.90 | PTGES2 (0.67) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5737554 | 0.90 | PDK1 (0.68) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5738172 | 0.90 | PDK1 (0.79) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5737589 | 0.90 | PDK1 (0.68) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5737922 | 0.90 | PDK1 (0.68) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5737845 | 0.90 | PDK1 (0.70) | PTGES2PDK1PDK2PDK3PDK4 | |
| SCHEMBL5735953 | 0.90 | PDK1 (0.79) | PTGES2PDK1PDK2PDK3PDK4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1064274-B1 | BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEDICAMENTS | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |