Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.37 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8693825 | 0.91 | PTGS2 (0.46) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8692201 | 0.82 | HTT (0.49) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8691904 | 0.82 | PTGS2 (0.49) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8693265 | 0.81 | PTGS2 (0.52) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL6353503 | 0.81 | PTGS2 (0.62) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL7059925 | 0.80 | PTGS2 (0.64) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8689254 | 0.78 | PTGS2 (0.52) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8639255 | 0.78 | PTGS2 (0.54) | PTGS2PTGS1CA12CA9CA2 | |
| SCHEMBL8525531 | 0.77 | PTGS2 (0.48) | PTGS2PTGS1 | |
| SCHEMBL8689089 | 0.76 | PTGS2 (0.56) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |