Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 3/20 | 0.47 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 5/20 | 0.38 |
| ▸ | CA1 | P00915 | 5/20 | 0.38 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | CA9 | Q16790 | 5/20 | 0.38 |
| ▸ | LPAR2 | Q9HBW0 | 4/20 | 0.38 |
| ▸ | FAAH | O00519 | 3/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13303172 | 1.00 | CES1 (0.47) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL10059143 | 1.00 | CES1 (0.47) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL17221054 | 1.00 | CES1 (0.47) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL29258947 | 1.00 | CES1 (0.47) | CES1CES2THRBTSHRMEN1 | |
| Hydrogen Sulfide SCHEMBL28850746 | 0.97 | CES2 (0.45) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL1608819 | 0.97 | CES2 (0.43) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL1395469 | 0.93 | CES1 (0.52) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL1118363 | 0.89 | — | — | |
| SCHEMBL3388721 | 0.89 | CES1 (0.44) | CES1CES2THRBTSHRMEN1 | |
| SCHEMBL18189677 | 0.88 | CES1 (0.42) | CES1CES2THRBMEN1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0415833-B1 | Optically active fluorine-containing alcohol compounds and liquid crystal compounds therefrom | SHOWA SHELL SEKIYU (JP) | 1996-09-11 | — | — | EP | disclosed |
| US-5096613-A | OPTICALLY ACTIVE FLUORINE-CONTAINING ALCOHOL COMPOUNDS AND LIQUID CRYSTAL COMPOUNDS THEREFROM | SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) | 1992-03-17 | — | — | US | disclosed |
| EP-0469800-A2 | Ferroelectric liquid crystal composition and liquid crystal device comprising the same | SHARP KABUSHIKI KAISHA (JP) | 1992-02-05 | — | — | EP | disclosed |