Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 8/20 | 0.52 |
| ▸ | YAP1 | P46937 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 7/20 | 0.41 |
| ▸ | CA9 | Q16790 | 7/20 | 0.41 |
| ▸ | CA12 | O43570 | 6/20 | 0.41 |
| ▸ | CA7 | P43166 | 6/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 6/20 | 0.41 |
| ▸ | CA4 | P22748 | 5/20 | 0.41 |
| ▸ | CA6 | P23280 | 5/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 5/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.41 |
| ▸ | CA5A | P35218 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9504735 | 0.80 | CYP19A1 (0.61) | PTGS2ALDH1A1MEN1PTGESCYP1A2 | |
| SCHEMBL9502669 | 0.79 | CYP19A1 (0.60) | PTGS2ALDH1A1MEN1PTGESCYP1A2 | |
| SCHEMBL9505608 | 0.78 | PTGS2 (0.55) | PTGS2ALDH1A1PTGS1KMT2ASMN1; SMN2 | |
| SCHEMBL8101585 | 0.78 | CA2 (0.52) | CA2YAP1CA1CA9CA12 | |
| SCHEMBL8091326 | 0.74 | CYP19A1 (0.67) | PTGS2CA2YAP1CA1CA9 | |
| SCHEMBL8091815 | 0.74 | CA2 (0.50) | CA2CA1CA9CA12CA7 | |
| SCHEMBL8091413 | 0.72 | PTGS2 (0.56) | PTGS2CA2CA1CA9CA12 | |
| SCHEMBL8100934 | 0.70 | CA2 (0.44) | PTGS2CA2CA1CA9CA12 | |
| SCHEMBL8101207 | 0.70 | PTGS2 (0.54) | PTGS2CA2CA1CA9CA12 | |
| SCHEMBL29617532 | 0.69 | CA2 (0.78) | CA2CA1CA9CA12CA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0848703-B1 | DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II | NYCOMED AUSTRIA GMBH (AT) | 2000-09-27 | — | — | EP | disclosed |
| US-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |