Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.61 |
| ▸ | GSK3B | P49841 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7573858 | 1.00 | PTGS2 (0.61) | PTGS2PTGS1GSK3BKDM4EALDH1A1 | |
| SCHEMBL7565471 | 0.83 | PTGS2 (0.56) | PTGS2PTGS1GSK3BALDH1A1MAPT | |
| SCHEMBL6326340 | 0.83 | PTGS2 (0.59) | PTGS2PTGS1GSK3BKDM4EALDH1A1 | |
| SCHEMBL7573008 | 0.78 | PTGS2 (0.57) | PTGS2PTGS1GSK3BKDM4EALDH1A1 | |
| SCHEMBL7566102 | 0.78 | PTGS2 (0.57) | PTGS2PTGS1GSK3BKDM4EALDH1A1 | |
| SCHEMBL3832067 | 0.76 | PTGS2 (1.00) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL7570479 | 0.76 | PTGS2 (0.64) | PTGS2PTGS1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL7567912 | 0.76 | PTGS2 (0.64) | PTGS2PTGS1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL7565211 | 0.76 | PTGS2 (1.00) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL7575463 | 0.76 | PTGS2 (0.51) | PTGS2PTGS1GSK3BMAPTRAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0889878-B1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2002-09-04 | — | — | EP | claimed |
| US-5817700-A | ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA, INC. (CA) | 1998-10-06 | — | — | US | claimed |
| EP-0889878-A1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1999-01-13 | — | — | EP | disclosed |
| US-5817700-A | ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA, INC. (CA) | 1998-10-06 | — | — | US | disclosed |
| WO-1997036863-A1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1997-10-09 | — | — | WO | disclosed |