Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 17/20 | 0.66 |
| ▸ | PTGS1 | P23219 | 10/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8637047 | 0.97 | PTGS2 (0.63) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL8165901 | 0.93 | PTGS2 (0.62) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL8525009 | 0.90 | PTGS2 (0.65) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL7773921 | 0.90 | PTGS2 (0.65) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL7055102 | 0.90 | PTGS2 (0.64) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8639180 | 0.88 | PTGS2 (0.53) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL8635925 | 0.88 | PTGS2 (0.58) | PTGS2PTGS1ABCB11ALDH1A1 | |
| Benzenesulfonamide SCHEMBL7927737 | 0.88 | PTGS2 (0.68) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| Benzenesulfonamide SCHEMBL8625195 | 0.88 | PTGS2 (0.68) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL8693648 | 0.87 | PTGS2 (0.67) | PTGS2PTGS1ABCB11ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2001527542-A | — | — | 2001-12-25 | — | — | JP | claimed |
| EP-0979077-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. Searle & Co. (US) | 2000-02-16 | — | — | EP | claimed |
| WO-1998047509-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1998-10-29 | — | — | WO | claimed |
| WO-1998016227-A9 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE TREATMENT AND PREVENTION OF NEOPLASIA | — | 1998-07-30 | — | — | WO | claimed |
| US-5760068-A | NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G.D. SEARLE & CO. (US) | 1998-06-02 | — | — | US | claimed |
| US-5760068-A | NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G.D. SEARLE & CO. (US) | 1998-06-02 | — | — | US | disclosed |
| US-5756529-A | ANTIINFLAMMATORY | G.D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |