Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV6 | Q9H1D0 | 5/20 | 0.43 |
| ▸ | ORAI1 | Q96D31 | 4/20 | 0.37 |
| ▸ | ORAI2 | Q96SN7 | 4/20 | 0.37 |
| ▸ | ORAI3 | Q9BRQ5 | 4/20 | 0.37 |
| ▸ | PCSK9 | Q8NBP7 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.35 |
| ▸ | FABP7 | O15540 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL28126445 | 0.75 | HDAC1 (0.34) | TRPV6FABP7MEN1S1PR2S1PR4 | |
| SCHEMBL874879 | 0.75 | TRPV6 (0.42) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL264493 | 0.75 | PCSK9 (0.42) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL1138975 | 0.73 | ALDH1A1 (0.42) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL3714673 | 0.73 | TSHR (0.43) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL3983901 | 0.72 | PCSK9 (0.44) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL3654165 | 0.72 | ENPP2 (0.38) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL28821752 | 0.70 | CYP3A4 (0.38) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL22323542 | 0.70 | ENPP2 (0.37) | TRPV6ORAI1ORAI2ORAI3PCSK9 | |
| SCHEMBL3411767 | 0.70 | TSHR (0.38) | TRPV6ORAI1ORAI2ORAI3PCSK9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106674264-A | Synthetic method for (2,2,2-trifluoroethoxyl) phenylboronic acid compounds | 苏州汉德创宏生化科技有限公司 | 2017-05-17 | — | — | CN | claimed |
| CN-106674264-A | Synthetic method for (2,2,2-trifluoroethoxyl) phenylboronic acid compounds | 苏州汉德创宏生化科技有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-106674264-A | Synthetic method for (2,2,2-trifluoroethoxyl) phenylboronic acid compounds | 苏州汉德创宏生化科技有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-106674264-A | Synthetic method for (2,2,2-trifluoroethoxyl) phenylboronic acid compounds | 苏州汉德创宏生化科技有限公司 | 2017-05-17 | — | — | CN | disclosed |