Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.50 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.50 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.50 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.32 |
| ▸ | BAD | Q92934 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2430178 | 0.87 | — | — | |
| Water SCHEMBL27516952 | 0.84 | CA1 (0.42) | ORAI1ORAI2ORAI3TRPV6CES2 | |
| SCHEMBL11019482 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL28172313 | 0.81 | CA1 (0.40) | ORAI1ORAI2ORAI3TRPV6CES2 | |
| Nitrogen SCHEMBL28463016 | 0.79 | NPC1 (0.40) | ORAI1ORAI2ORAI3TRPV6CES2 | |
| SCHEMBL25453806 | 0.74 | LTA4H (0.59) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL12260949 | 0.72 | SOS1 (0.48) | ALDH1A1 | |
| SCHEMBL16595574 | 0.72 | APP (0.37) | CA1CA2CA7CA9ACHE | |
| Boric Acid SCHEMBL2461186 | 0.71 | ORAI1 (0.50) | ORAI1ORAI2ORAI3TRPV6NPC1 | |
| Boric Acid SCHEMBL29013467 | 0.71 | ALDH1A1 (0.50) | ORAI1ORAI2ORAI3TRPV6CES2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020059399-A1 | PHOTOCURABLE COMPOSITION, DENTAL PLATE LINER, AND KIT FOR PREPARING THESE | 株式会社トクヤマデンタル | 2020-03-26 | — | — | WO | disclosed |