Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 17/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 8/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | NAT1 | P18440 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5204230 | 0.82 | PTGS2 (0.67) | PTGS2PTGS1 | |
| SCHEMBL5208836 | 0.71 | PTGS2 (0.69) | PTGS2PTGS1 | |
| SCHEMBL5202982 | 0.70 | PTGS2 (0.65) | PTGS2PTGS1 | |
| SCHEMBL5205319 | 0.68 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL5208009 | 0.68 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL4403458 | 0.68 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL29385088 | 0.68 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL5210653 | 0.66 | PTGS2 (0.80) | PTGS2PTGS1 | |
| SCHEMBL5204237 | 0.63 | PTGS2 (0.58) | PTGS2PTGS1 | |
| SCHEMBL5204392 | 0.61 | PTGS2 (0.72) | 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 |
|---|---|---|---|---|---|---|---|
| US-5698584-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA, INC. (CA) | 1997-12-16 | — | — | US | disclosed |