Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SELL | P14151 | 1/20 | 0.36 |
| ▸ | SELP | P16109 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | MPI | P34949 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL564668 | 0.97 | SELL (0.38) | SELLSELPSELEACHECA3 | |
| SCHEMBL3687919 | 0.82 | SELL (0.43) | SELLSELPSELEACHECA3 | |
| SCHEMBL27565914 | 0.80 | SELL (0.36) | SELLSELPSELEACHECA3 | |
| Methyl Alcohol SCHEMBL9652269 | 0.78 | CA1 (0.40) | SELLSELPSELEACHECES2 | |
| SCHEMBL169896 | 0.78 | CA1 (0.38) | ACHECES2CES1HDAC1HDAC6 | |
| SCHEMBL3047779 | 0.77 | SELL (0.38) | SELLSELPSELEACHECA3 | |
| SCHEMBL374990 | 0.77 | ACHE (0.43) | SELLSELPSELEACHECA3 | |
| SCHEMBL30413280 | 0.77 | ACHE (0.43) | SELLSELPSELEACHECA3 | |
| SCHEMBL368571 | 0.76 | CES2 (0.36) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL258682 | 0.73 | CES2 (0.38) | SELLSELPSELECA3CA6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101709052-A | Preparation method of 2-(3-trifluoromethyl phenoxy) niacin | NANJING FIRST AGRICULTURAL CHE | 2010-05-19 | — | — | CN | disclosed |