Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11910300 | 0.84 | CYP2A6 (0.54) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL22589949 | 0.83 | HRH3 (0.49) | HRH3ALDH1A1CA2 | |
| SCHEMBL18677419 | 0.82 | PPARA (0.48) | CYP2A6LOXL2TSHRHSD17B10EPHX2 | |
| SCHEMBL7922825 | 0.81 | LOXL2 (0.50) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL29065555 | 0.77 | TSHR (0.54) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL5729581 | 0.77 | CYP2A6 (0.46) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL1004267 | 0.76 | LOXL2 (0.64) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL10669125 | 0.76 | CYP2A6 (0.54) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL18560067 | 0.76 | KCNJ1 (0.48) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 | |
| SCHEMBL14460154 | 0.76 | TSHR (0.57) | CYP2A6LOXL2TSHRHSD17B10KCNJ1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0535635-B1 | Tolane derivative, liquid crystal composition containing the derivative, and liquid crystal display device using the composition | SEIKO EPSON CORP (JP) | 1996-08-21 | — | — | EP | disclosed |
| EP-0535635-A1 | Tolane derivative, liquid crystal composition containing the derivative, and liquid crystal display device using the composition | SEIKO EPSON CORPORATION (JP) | 1993-04-07 | — | — | EP | disclosed |