Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7536789 | 0.90 | PTGS2 (0.43) | PTGS2PTGS1CA9HPGDCTSB | |
| SCHEMBL6619309 | 0.90 | PTGS2 (0.43) | PTGS2PTGS1CA9HPGDCTSB | |
| SCHEMBL7535016 | 0.81 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL6622652 | 0.77 | PTGS2 (0.41) | PTGS2PTGS1HPGDMAPT | |
| SCHEMBL7665809 | 0.77 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL7671385 | 0.76 | PTGS2 (0.44) | PTGS2PTGS1 | |
| SCHEMBL7669405 | 0.76 | PTGS2 (0.44) | PTGS2PTGS1 | |
| SCHEMBL7670248 | 0.76 | PTGS2 (0.45) | PTGS2PTGS1MAPTKMT2A | |
| SCHEMBL7670052 | 0.74 | PTGS2 (0.43) | PTGS2PTGS1 | |
| SCHEMBL6622930 | 0.73 | PTGS2 (0.46) | 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 |
|---|---|---|---|---|---|---|---|
| US-6472416-B1 | Sulfonylphenylpyrazole compounds useful as COX-2 inhibitors | ABBOTT LABORATORIES | 2002-10-29 | — | — | US | disclosed |
| EP-1206474-A1 | SULFONYLPHENYLPYRAZOLE COMPOUNDS USEFUL AS COX-2 INHIBITORS | ABBOTT LABORATORIES (US) | 2002-05-22 | — | — | EP | disclosed |
| WO-2001016138-A1 | SULFONYLPHENYLPYRAZOLE COMPOUNDS USEFUL AS COX-2 INHIBITORS | ABBOTT LABORATORIES (US) | 2001-03-08 | — | — | WO | disclosed |