Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8003087 | 0.74 | CYSLTR1 (0.35) | — | |
| SCHEMBL1420100 | 0.74 | CYSLTR1 (0.46) | — | |
| SCHEMBL6997284 | 0.69 | SIGMAR1 (0.38) | PTGS2SIGMAR1PTGS1SMN1; SMN2KMT2A | |
| SCHEMBL17314725 | 0.67 | PTGS2 (0.38) | PTGS2PTGS1PDE4BKMT2AADORA2A | |
| SCHEMBL13880121 | 0.67 | HRH3 (0.39) | SIGMAR1 | |
| SCHEMBL6993378 | 0.66 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL6989032 | 0.66 | PTGS2 (0.54) | PTGS2PTGS1 | |
| Biphenyl SCHEMBL28551760 | 0.64 | CA1 (0.53) | KMT2AADORA2AADORA1 | |
| SCHEMBL6991312 | 0.63 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL6986739 | 0.63 | PTGS2 (0.54) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0799218-B1 | DIARYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC (CA) | 2003-02-19 | — | — | EP | disclosed |
| US-6222048-B1 | AS ANTIINFLAMMATORY, ANTIPYRETIC AND ANALGESIC AGENTS; INHIBITS HORMONE INDUCED UTERINE CONTRACTION; ANTICANCER PROPERTIES; SIDE EFFECT REDUCTION | MERCK FROSST CANADA & CO. (CA) | 2001-04-24 | — | — | US | disclosed |
| WO-1996019469-A1 | DIARYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-06-27 | — | — | WO | disclosed |