Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7489560 | 1.00 | PTGS2 (0.36) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7489570 | 1.00 | PTGS2 (0.36) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7489574 | 1.00 | PTGS2 (0.36) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL8189822 | 0.80 | MMP14 (0.36) | PTGS2PTGS1ENPP2LMNATSHR | |
| SCHEMBL8189819 | 0.80 | MMP14 (0.36) | PTGS2PTGS1ENPP2LMNATSHR | |
| SCHEMBL7487657 | 0.73 | ENPP2 (0.41) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7487653 | 0.73 | ENPP2 (0.41) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7487665 | 0.73 | ENPP2 (0.41) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7487673 | 0.73 | ENPP2 (0.41) | PTGS2PTGS1ENPP2AKR1C3AKR1C2 | |
| SCHEMBL7495881 | 0.68 | PTGS2 (0.36) | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863891-B1 | (METHYLSULFONYL)PHENYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC (CA) | 2002-12-11 | — | — | EP | disclosed |
| EP-0904269-B1 | 3,4-DIARYL-2-HYDROXY-2,5-DIHYDROFURANS AS PRODRUGS TO COX-2 INHIBITORS | MERCK FROSST CANADA INC (CA) | 2002-01-23 | — | — | EP | disclosed |
| US-6169188-B1 | TREATING CYCLOOXYGENASE-2 MEDIATED DISEASES | MERCK FROSST CANADA & CO. (CA) | 2001-01-02 | — | — | US | disclosed |
| US-6057319-A | CYCLOOXYGENASE-2 INHIBITORS; NON-STEROIDAL ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA & CO. (CA) | 2000-05-02 | — | — | US | disclosed |
| US-5981576-A | (Methylsulfonyl)phenyl-2-(5H)-furanones as COX-2 inhibitors | MERCK FROSST CANADA, INC. (CA) | 1999-11-09 | — | — | US | disclosed |
| US-5698584-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA, INC. (CA) | 1997-12-16 | — | — | US | disclosed |