Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | GSR | P00390 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5311445 | 0.77 | GSR (0.44) | EPHX2PTGS2AKR1C3GSRKMT2A | |
| SCHEMBL4772305 | 0.74 | PTGS2 (0.53) | EPHX2PTGS2AKR1C2AKR1C1AKR1C3 | |
| SCHEMBL6970870 | 0.74 | PTGS2 (0.53) | EPHX2PTGS2AKR1C2AKR1C1AKR1C3 | |
| SCHEMBL5107498 | 0.73 | MAPK1 (0.58) | PTGS2AKR1C2AKR1C1AKR1C3GAA | |
| SCHEMBL9118822 | 0.73 | PTGS2 (0.45) | EPHX2PTGS2AKR1C2AKR1C1AKR1C3 | |
| SCHEMBL9969418 | 0.73 | GSR (0.56) | EPHX2AKR1C3GSR | |
| SCHEMBL6050635 | 0.72 | CES2 (0.64) | EPHX2PTGS2AKR1C2AKR1C1AKR1C3 | |
| SCHEMBL4030635 | 0.72 | PTGS2 (0.62) | PTGS2AKR1C2AKR1C1AKR1C3ESR2 | |
| SCHEMBL10541229 | 0.71 | GSR (0.54) | EPHX2PTGS2GSRKMT2A | |
| SCHEMBL6302162 | 0.71 | FAAH (0.53) | EPHX2PTGS2AKR1C2AKR1C1AKR1C3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0743938-B1 | SUBSTITUTED SPIRO COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 1999-04-21 | — | — | EP | disclosed |
| EP-0724566-B1 | 1,2-DIARYLCYCLOPENTENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 1998-10-07 | — | — | EP | disclosed |
| US-5663180-A | ANTIARTHRITIC, ANTIINFLAMMATORY AGENTS | G.D. SEARLE & CO. (US) | 1997-09-02 | — | — | US | disclosed |
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |
| US-5393790-A | Diphenyl- or phenyl/pyridyl-substituted spiroheptenes, -octenes,-nonenes or -decenes; cyclooxygenase II inhibitors; side effect reduction; antipyretics; antiarthritic agents | G.D. SEARLE & CO. (US) | 1995-02-28 | — | — | US | disclosed |