Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 7/20 | 0.40 |
| ▸ | CA1 | P00915 | 6/20 | 0.40 |
| ▸ | CA9 | Q16790 | 6/20 | 0.40 |
| ▸ | CA5A | P35218 | 5/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 3/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | GRIA2 | P42262 | 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 | |
|---|---|---|---|---|
| SCHEMBL9117163 | 0.98 | PTGS2 (0.51) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9118062 | 0.95 | PTGS2 (0.53) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9116432 | 0.93 | PTGS2 (0.43) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9239184 | 0.91 | PTGS2 (0.43) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9118699 | 0.89 | PTGS2 (0.53) | PTGS2PTGS1ALOX5APGRIA2 | |
| SCHEMBL9117725 | 0.88 | PTGS2 (0.45) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9117472 | 0.87 | PTGS2 (0.53) | PTGS2PTGS1ALOX5APGRIA2 | |
| SCHEMBL9117882 | 0.86 | CA12 (0.55) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9118587 | 0.86 | PTGS2 (0.43) | PTGS2PTGS1CA2CA1CA9 | |
| SCHEMBL9116766 | 0.86 | PTGS2 (0.49) | PTGS2PTGS1CA2CA1CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | claimed |
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |