Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.51 |
| ▸ | PTGES2 | Q9H7Z7 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8657816 | 0.88 | PTGS2 (0.50) | PTGS2PTGS1PTGES2ERN1 | |
| SCHEMBL8661248 | 0.87 | PTGS2 (0.46) | PTGS2PTGS1PTGES2CA12CA1 | |
| SCHEMBL8656781 | 0.87 | CA9 (0.54) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL8659792 | 0.86 | PTGS2 (0.59) | PTGS2PTGS1PTGES2CA12CA1 | |
| SCHEMBL8659436 | 0.86 | PTGS2 (0.51) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL8661261 | 0.84 | PTGS1 (0.40) | PTGS2PTGS1PTGES2CA12CA1 | |
| SCHEMBL8660023 | 0.83 | PTGS2 (0.74) | PTGS2PTGS1PTGES2BRD4PTPRC | |
| SCHEMBL6733291 | 0.83 | PTGS2 (0.73) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL8656732 | 0.83 | PTGS2 (0.53) | PTGS2PTGS1PTGES2CA1CA2 | |
| SCHEMBL8657870 | 0.82 | PTGS2 (0.45) | PTGS2PTGS1CA12CA1CA2 |
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-5739166-A | ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT | G.D. SEARLE & CO. (US) | 1998-04-14 | — | — | US | disclosed |