Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 5/20 | 0.60 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.60 |
| ▸ | CA9 | Q16790 | 5/20 | 0.53 |
| ▸ | CA1 | P00915 | 4/20 | 0.53 |
| ▸ | CA2 | P00918 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL8101123 | 0.85 | PTGS1 (0.56) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8100686 | 0.85 | PTGS1 (0.60) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8101694 | 0.82 | CA2 (0.47) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8098757 | 0.82 | CA2 (0.50) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8091420 | 0.80 | CA2 (0.51) | PTGS2CA9CA1CA2CA12 | |
| SCHEMBL8091416 | 0.79 | PTGS1 (0.56) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8101811 | 0.79 | CA2 (0.47) | PTGS2CA9CA1CA2CA12 | |
| SCHEMBL8105031 | 0.77 | SOS1 (0.59) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8099553 | 0.77 | PTGS1 (0.56) | PTGS1PTGS2CA9CA1CA2 | |
| SCHEMBL8105340 | 0.75 | PTGS1 (0.57) | PTGS1PTGS2CA9CA1CA2 |
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 |