Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.52 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 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 | |
|---|---|---|---|---|
| SCHEMBL9117079 | 0.88 | CA2 (0.40) | PTGS2PTGS1CCR6 | |
| SCHEMBL9119788 | 0.86 | CA2 (0.40) | PTGS2PTGS1CCR6 | |
| SCHEMBL9117854 | 0.83 | CA2 (0.42) | PTGS2PTGS1CCR6 | |
| SCHEMBL9117471 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL9118415 | 0.81 | PTGS2 (0.56) | PTGS2PTGS1 | |
| SCHEMBL9126561 | 0.81 | PTGS2 (0.63) | PTGS2PTGS1 | |
| SCHEMBL8974377 | 0.81 | PTGS2 (0.42) | PTGS2PTGS1LRRK2EPHX2CCR6 | |
| SCHEMBL9117705 | 0.81 | PTGS2 (0.49) | PTGS2PTGS1LRRK2CCR6 | |
| SCHEMBL9119469 | 0.80 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL9118093 | 0.80 | PTGS2 (0.53) | 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 1 patent. 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 | disclosed |