Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7777224 | 0.90 | PTGS2 (0.47) | PTGS1PTGS2CA12CA9 | |
| SCHEMBL7780439 | 0.90 | PTGS2 (0.48) | PTGS1PTGS2CA12CA9 | |
| SCHEMBL7773100 | 0.84 | PTGS2 (0.45) | PTGS1PTGS2 | |
| SCHEMBL8167387 | 0.82 | PTGS1 (0.46) | PTGS1PTGS2CA12CA9FAAH | |
| SCHEMBL7777664 | 0.82 | PTGS2 (0.46) | PTGS1PTGS2 | |
| SCHEMBL7779590 | 0.80 | KMT2A (0.47) | PTGS1PTGS2CA12CA9 | |
| SCHEMBL7780664 | 0.80 | PTGS2 (0.43) | PTGS1PTGS2 | |
| SCHEMBL7777722 | 0.80 | PTGS2 (0.43) | PTGS1PTGS2FAAHKCNH2 | |
| SCHEMBL7780884 | 0.80 | PTGS2 (0.53) | PTGS1PTGS2FAAHKCNH2 | |
| SCHEMBL7780558 | 0.80 | PTGS2 (0.48) | PTGS1PTGS2 |
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-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |