Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13624617 | 0.91 | ESR2 (0.42) | PTGS2PTGS1ESR2 | |
| SCHEMBL13624613 | 0.91 | ESR2 (0.42) | PTGS2PTGS1ESR2 | |
| SCHEMBL4367488 | 0.85 | PTGS2 (0.46) | PTGS2ESR2 | |
| SCHEMBL4364672 | 0.84 | PTGS2 (0.47) | PTGS2PTGS1ESR2 | |
| SCHEMBL4364681 | 0.84 | PTGS2 (0.47) | PTGS2PTGS1ESR2 | |
| SCHEMBL13624619 | 0.81 | PTGS2 (0.44) | PTGS2PTGS1ESR2 | |
| SCHEMBL3987417 | 0.81 | PTGS2 (0.47) | PTGS2ESR2 | |
| SCHEMBL3987412 | 0.81 | PTGS2 (0.47) | PTGS2ESR2 | |
| SCHEMBL4367496 | 0.80 | PTGS2 (0.47) | PTGS2ESR2 | |
| SCHEMBL4367492 | 0.80 | PTGS2 (0.47) | PTGS2ESR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1711459-A4 | NITRIC OXIDE RELEASING PRODRUGS OF DIARYL-2-(5H)-FURANONES AS CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST COMPANY (CA) | 2008-01-02 | — | — | EP | disclosed |
| EP-1711459-A1 | NITRIC OXIDE RELEASING PRODRUGS OF DIARYL-2-(5H)-FURANONES AS CYCLOOXYGENASE-2 INHIBITORS | Merck Frosst Company (CA) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005070883-A1 | NITRIC OXIDE RELEASING PRODRUGS OF DIARYL-2-(5H)-FURANONES AS CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST COMPANY (CA) | 2005-08-04 | — | — | WO | disclosed |