Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 3/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.41 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | SCN1A | P35498 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8640427 | 0.92 | DNM1 (0.42) | CA1CA2CA9F2PRSS1 | |
| Octane SCHEMBL11401295 | 0.89 | CA1 (0.47) | CA1CA2CA9F2PRSS1 | |
| SCHEMBL8959209 | 0.85 | KCNH2 (0.43) | CA1CA2CA9HTR6CYP1A2 | |
| Tetrabuthylammonium SCHEMBL2641498 | 0.85 | CA9 (0.44) | CA1CA2CA9F2PRSS1 | |
| Tetrabuthylammonium SCHEMBL11502023 | 0.84 | SLC22A1 (0.43) | CA2CA9CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL28082394 | 0.83 | CA1 (0.41) | CA1CA2CA9F2PRSS1 | |
| SCHEMBL9784990 | 0.82 | F2 (0.33) | CA1CA2CA9F2PRSS1 | |
| Tetrabuthylammonium SCHEMBL29130217 | 0.81 | CYP1A2 (0.49) | CA2CYP1A2KDM4EALDH1A1CYP2C9 | |
| Tetrabuthylammonium SCHEMBL29130237 | 0.81 | CYP1A2 (0.49) | CA2CYP1A2KDM4EALDH1A1CYP2C9 | |
| Tetramethylammonium Ion SCHEMBL11794272 | 0.81 | CA1 (0.55) | CA1CA2CA9F2PRSS1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4723499-B2 | — | — | 2011-07-13 | — | — | JP | claimed |
| EP-1668039-A1 | ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS | 3M Innovative Properties Company (US) | 2006-06-14 | — | — | EP | claimed |
| WO-2005035591-A1 | ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-04-21 | — | — | WO | claimed |
| EP-1668039-A1 | ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS | 3M Innovative Properties Company (US) | 2006-06-14 | — | — | EP | disclosed |
| EP-1663115-A1 | DENTAL COMPOSITIONS AND METHODS WITH ARYLSULFINATE SALTS | 3M Innovative Properties Company (US) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005034884-A1 | DENTAL COMPOSITIONS AND METHODS WITH ARYLSULFINATE SALTS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-04-21 | — | — | WO | disclosed |
| WO-2005035591-A1 | ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-04-21 | — | — | WO | disclosed |