Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | CEL | P19835 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8589905 | 0.98 | TTR (0.42) | TTRPTGS2PTGDR2PTGES2CEL | |
| SCHEMBL28163309 | 0.85 | PTGES2 (0.45) | PTGS2PTGES2 | |
| SCHEMBL4279326 | 0.83 | PTGS2 (0.46) | PTGS2PTGDR2PTGES2KMO | |
| SCHEMBL8588503 | 0.82 | PTGS2 (0.37) | PTGS2PTGDR2PTGES2CELFFAR2 | |
| SCHEMBL10408635 | 0.82 | PTGS2 (0.40) | TTRPTGS2PTGDR2PTGES2CEL | |
| SCHEMBL27952944 | 0.81 | PTGS2 (0.45) | PTGS2PTGDR2PTGES2KMO | |
| Water SCHEMBL30194738 | 0.81 | PTGS2 (0.39) | TTRPTGS2PTGDR2PTGES2CEL | |
| SCHEMBL28035679 | 0.81 | PTGS2 (0.42) | PTGS2PTGDR2 | |
| SCHEMBL23647454 | 0.79 | PTGS2 (0.43) | PTGS2 | |
| SCHEMBL28773240 | 0.78 | TDO2 (0.44) | PTGS2PTGDR2CELKMOTDO2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105611921-A | Novel analgesic composition | VAPOGENIX INC | 2016-05-25 | — | — | CN | disclosed |