Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.39 |
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.38 |
| ▸ | PRKCG | P05129 | 2/20 | 0.38 |
| ▸ | PRKCB | P05771 | 2/20 | 0.38 |
| ▸ | PRKCA | P17252 | 2/20 | 0.38 |
| ▸ | PRKCH | P24723 | 2/20 | 0.38 |
| ▸ | PRKCI | P41743 | 2/20 | 0.38 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.38 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.38 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.38 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7779388 | 1.00 | ALDH1A1 (0.50) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7778933 | 0.98 | ALDH1A1 (0.47) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7778929 | 0.98 | ALDH1A1 (0.47) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7779306 | 0.92 | ALDH1A1 (0.54) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7781592 | 0.92 | CYP1A2 (0.40) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7781589 | 0.92 | CYP1A2 (0.40) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL7779312 | 0.92 | ALDH1A1 (0.54) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL24562883 | 0.90 | ALDH1A1 (0.61) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL10707048 | 0.89 | ALDH1A1 (0.42) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 | |
| SCHEMBL10707051 | 0.89 | ALDH1A1 (0.42) | ALDH1A1EPHX1SPHK1SPHK2PRKD3 |
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-0732330-B1 | Di-1,3-dioxane derivatives useful as liquid crystals | ROLIC AG (CH) | 2001-09-12 | — | — | EP | disclosed |
| US-5667721-A | Liquid crystalline di-1,3-dioxane derivatives | ROLIC AG (CH) | 1997-09-16 | — | — | US | disclosed |
| EP-0732330-A1 | Di-1,3-dioxane derivatives useful as liquid crystals | F. HOFFMANN-LA ROCHE AG (CH) | 1996-09-18 | — | — | EP | disclosed |