Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9809644 | 1.00 | PPARA (0.43) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9809648 | 1.00 | PPARA (0.43) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9224875 | 0.83 | PPARA (0.46) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL5179731 | 0.82 | PPARA (0.48) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL129098 | 0.82 | PPARA (0.48) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9342859 | 0.81 | PPARA (0.47) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9342860 | 0.81 | PPARA (0.47) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9746372 | 0.81 | PPARA (0.47) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL6871353 | 0.81 | PPARA (0.47) | PPARAHTTKAT8KDM4ERARB | |
| SCHEMBL9809646 | 0.81 | CTRC (0.47) | PPARG |
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-5189204-A | Optical active 3-(2-trifluoro-1-hydroxyethyl) propenyl benzyl ether, derivatives thereof, method for preparing the same and use thereof for liquid crystal compound | SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) | 1993-02-23 | — | — | US | disclosed |
| US-5167861-A | Tristable phase; high speed of response | SHOWA SHELL SEKIYU K.K. (JP) | 1992-12-01 | — | — | US | disclosed |
| US-5047346-A | Resolution, esterification | SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) | 1991-09-10 | — | — | US | disclosed |