Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.60 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 5/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.37 |
| ▸ | RPS6KA5 | O75582 | 4/20 | 0.37 |
| ▸ | AKT1 | P31749 | 4/20 | 0.37 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.37 |
| ▸ | PRKG2 | Q13237 | 4/20 | 0.37 |
| ▸ | PRKG1 | Q13976 | 4/20 | 0.37 |
| ▸ | PKN2 | Q16513 | 4/20 | 0.37 |
| ▸ | GSK3A | P49840 | 4/20 | 0.37 |
| ▸ | NEK4 | P51957 | 3/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL363565 | 0.89 | GPBAR1 (0.62) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL370416 | 0.89 | GPBAR1 (0.62) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL370417 | 0.89 | GPBAR1 (0.62) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL362642 | 0.88 | GPBAR1 (0.61) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL369687 | 0.88 | GPBAR1 (0.61) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL369688 | 0.88 | GPBAR1 (0.61) | GPBAR1CA12CA1CA2CA9 | |
| SCHEMBL1389598 | 0.86 | GPBAR1 (0.58) | GPBAR1EPHX2GSK3BROCK1CLK4 | |
| SCHEMBL361993 | 0.86 | GPBAR1 (0.58) | GPBAR1EPHX2GSK3BROCK1CLK4 | |
| SCHEMBL1389878 | 0.84 | GPBAR1 (0.64) | GPBAR1EPHX2GSK3BROCK1CLK4 | |
| SCHEMBL363119 | 0.84 | GPBAR1 (0.64) | GPBAR1EPHX2GSK3BROCK1CLK4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | claimed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | claimed |
| EP-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |