Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 13/20 | 0.53 |
| ▸ | CA2 | P00918 | 13/20 | 0.53 |
| ▸ | CA9 | Q16790 | 13/20 | 0.53 |
| ▸ | CA12 | O43570 | 11/20 | 0.53 |
| ▸ | CA7 | P43166 | 7/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 7/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.51 |
| ▸ | CA4 | P22748 | 2/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8093790 | 1.00 | CA1 (0.53) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8106457 | 1.00 | CA1 (0.53) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8100571 | 0.88 | PTGS2 (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8093354 | 0.88 | PTGS2 (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8438289 | 0.88 | PTGS2 (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8094164 | 0.88 | MAOA (0.48) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8092672 | 0.76 | PTGS2 (0.43) | PTGS2MAOAMAOBPTGS1MEN1 | |
| SCHEMBL8441152 | 0.75 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL8094120 | 0.75 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL8441150 | 0.75 | PTGS2 (0.46) | PTGS2PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1058682-A1 | HETEROCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USES IN THERAPEUTICS | LABORATOIRES UPSA (FR) | 2000-12-13 | — | — | EP | disclosed |
| US-6004994-A | ANTIINFLAMMATORY AGENTS, CYCLOOXYGENASE INHIBITORS AND ANALGESICS | LABORATOIRES UPSA (FR) | 1999-12-21 | — | — | US | disclosed |
| WO-1999043664-A1 | HETEROCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USES IN THERAPEUTICS | LABORATOIRES UPSA (FR) | 1999-09-02 | — | — | WO | disclosed |