Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.68 |
| ▸ | CA12 | O43570 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA9 | Q16790 | 2/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8646859 | 0.96 | PTGS2 (0.68) | PTGS2CA12CA2CA9PTGS1 | |
| SCHEMBL8770202 | 0.91 | PTGS2 (0.79) | PTGS2CA12CA2CA9PTGS1 | |
| SCHEMBL1687503 | 0.91 | PTGS2 (0.79) | PTGS2CA12CA2CA9PTGS1 | |
| SCHEMBL17153735 | 0.86 | PTGS2 (0.50) | PTGS2CA12CA2CA9 | |
| SCHEMBL2140712 | 0.85 | PTGS2 (0.53) | PTGS2 | |
| SCHEMBL25490780 | 0.84 | PTGS2 (0.53) | PTGS2CA12CA2CA9PTGS1 | |
| SCHEMBL22973430 | 0.82 | PTGS2 (0.52) | PTGS2CA12CA2CA9PTGS1 | |
| SCHEMBL21296960 | 0.82 | HSD17B1 (0.63) | PTGS2CA12CA2CA9 | |
| SCHEMBL12740176 | 0.82 | CA2 (0.71) | PTGS2CA12CA2CA9CA1 | |
| SCHEMBL4256150 | 0.82 | PTGS2 (0.66) | PTGS2CA12CA2CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0794942-A1 | SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-09-17 | — | — | EP | disclosed |
| WO-1996016934-A1 | SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-06-06 | — | — | WO | disclosed |