Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.45 |
| ▸ | EDNRA | P25101 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | USP1 | O94782 | 1/20 | 0.39 |
| ▸ | USP8 | P40818 | 1/20 | 0.39 |
| ▸ | OTUB1 | Q96FW1 | 1/20 | 0.39 |
| ▸ | USP36 | Q9P275 | 1/20 | 0.39 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5709000 | 0.82 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL7154383 | 0.80 | MAOA (0.41) | MAOAMAOBLMNAPOLBUSP2 | |
| SCHEMBL7154393 | 0.74 | MAOA (0.42) | PTGS2MAOAMAOBACLY | |
| SCHEMBL28305921 | 0.71 | PTGS2 (0.43) | PTGS2MAOAMAOBPTGS1 | |
| SCHEMBL8502395 | 0.70 | PTGS2 (0.51) | PTGS2EDNRALMNAPOLBUSP2 | |
| SCHEMBL6816328 | 0.69 | PTGS2 (0.69) | PTGS2LMNAPOLBPTGS1 | |
| SCHEMBL5708965 | 0.69 | PTGS2 (0.65) | PTGS2 | |
| SCHEMBL7259192 | 0.67 | PTGS2 (0.53) | PTGS2PTGS1 | |
| SCHEMBL7108267 | 0.66 | PTGS2 (0.46) | PTGS2PTGS1ACLY | |
| SCHEMBL7597965 | 0.66 | BAZ2B (0.35) | PTGS2 |
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-1299372-A1 | PYRONES AS INHIBITORS OF CYCLOOXYGENASE-2 | MERCK FROSST CANADA INC. (CA) | 2003-04-09 | — | — | EP | disclosed |
| WO-2002002547-A1 | PYRONES AS INHIBITORS OF CYCLOOXYGENASE-2 | MERCK FROSST CANADA & CO. (CA) | 2002-01-10 | — | — | WO | disclosed |