Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV6 | Q9H1D0 | 3/20 | 0.46 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.46 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.46 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL5317235 | 0.92 | ORAI1 (0.41) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL2475622 | 0.85 | ORAI1 (0.48) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL28491367 | 0.85 | MGLL (0.43) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL28857842 | 0.81 | CA2 (0.55) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL29133596 | 0.80 | CA2 (0.46) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL2420030 | 0.79 | CA1 (0.42) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL28610015 | 0.79 | TRPV6 (0.56) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL14983344 | 0.79 | ORAI1 (0.39) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| SCHEMBL18204467 | 0.78 | CA1 (0.56) | TRPV6ORAI1ORAI2ORAI3CA1 | |
| Anthracene SCHEMBL5574730 | 0.78 | CA1 (0.42) | TRPV6ORAI1ORAI2ORAI3CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113214318-B | (3- (1H-1,2, 3-triazole) phenyl) phosphoric acid derivative and preparation method and application thereof | 四川大学 | 2022-05-27 | — | — | CN | disclosed |
| CN-113214318-A | (3- (1H-1,2, 3-triazole) phenyl) phosphoric acid derivative and preparation method and application thereof | 四川大学 | 2021-08-06 | — | — | CN | disclosed |