Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.58 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.50 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6728363 | 0.86 | PTGS2 (0.68) | PTGS2PTGS1PTGDR2KIF11 | |
| Hydrogen Sulfide SCHEMBL27744403 | 0.84 | PTGS2 (0.69) | PTGS2PTGS1PTGDR2 | |
| Trifluoromethanesulfonic Acid SCHEMBL27765516 | 0.82 | PTGS2 (0.54) | PTGS2SLC6A9PTGS1PTGDR2 | |
| Hydrogen Sulfide SCHEMBL27853272 | 0.81 | PTGS2 (0.61) | PTGS2PTGS1PTGDR2 | |
| SCHEMBL28160376 | 0.80 | PTGS2 (0.54) | PTGS2SLC6A9PTGS1PTGDR2KIF11 | |
| SCHEMBL6913549 | 0.79 | PTGS2 (0.65) | PTGS2SLC6A9PTGDR2 | |
| SCHEMBL7506839 | 0.77 | PTGS2 (0.72) | PTGS2PTGDR2KIF11 | |
| SCHEMBL5502727 | 0.75 | PTGS2 (1.00) | PTGS2PTGS1 | |
| SCHEMBL30023096 | 0.75 | KIF11 (0.58) | PTGDR2KIF11BACE1 | |
| SCHEMBL27781322 | 0.75 | KIF11 (0.58) | PTGDR2KIF11BACE1 |
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 |