Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.41 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.35 |
| ▸ | FEN1 | P39748 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.34 |
| ▸ | F10 | P00742 | 3/20 | 0.34 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8631083 | 0.86 | PTGES2 (0.53) | PTGS2PTGS1PTGES2ALOX5APFEN1 | |
| SCHEMBL7779777 | 0.85 | PTGS2 (0.49) | PTGS2PTGS1CA2CA9CA1 | |
| SCHEMBL8628206 | 0.83 | PTGES2 (0.39) | PTGS2PTGES2ALOX5APFEN1CA2 | |
| SCHEMBL8631176 | 0.81 | PTGS2 (0.46) | PTGS2PTGS1PTGES2CA2CA9 | |
| SCHEMBL8627977 | 0.80 | PTGS2 (0.50) | PTGS2PTGS1PTGES2CA2CA9 | |
| SCHEMBL7779346 | 0.80 | PTGS2 (0.48) | PTGS2PTGS1 | |
| SCHEMBL8630031 | 0.79 | PTGS2 (0.41) | PTGS2PTGS1ALOX5APFEN1CA2 | |
| SCHEMBL8631662 | 0.79 | F10 (0.42) | PTGES2CA2CA9CA1NPC1 | |
| SCHEMBL8628731 | 0.78 | GYS1 (0.47) | PTGS2PTGS1ALOX5APFEN1ALDH1A1 | |
| SCHEMBL8632840 | 0.78 | LRRK2 (0.42) | PTGS2PTGS1CA2CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |