Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.36 |
| ▸ | CHRNG | P07510 | 1/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CHRND | Q07001 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5822629 | 0.91 | PTGS2 (0.42) | PTGS2PTGS1APPAKR1C3AKR1C2 | |
| SCHEMBL5799056 | 0.89 | PTGS2 (0.45) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL5799060 | 0.89 | PTGS2 (0.45) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL5813339 | 0.89 | PTGS2 (0.43) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL5813335 | 0.89 | PTGS2 (0.43) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL5798692 | 0.88 | APP (0.37) | PTGS2APPCHRNA1CHRNGCHRNB1 | |
| SCHEMBL6425175 | 0.88 | PTGS2 (0.56) | PTGS2PTGS1SLC6A3AKR1C3AKR1C2 | |
| SCHEMBL6425088 | 0.88 | PTGS2 (0.56) | PTGS2PTGS1SLC6A3AKR1C3AKR1C2 | |
| SCHEMBL5800804 | 0.88 | PTGS2 (0.56) | PTGS2PTGS1SLC6A3AKR1C3AKR1C2 | |
| SCHEMBL5808091 | 0.87 | AKR1C3 (0.42) | PTGS2PTGS1AKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | disclosed |