Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL28704095 | 0.84 | ACHE (0.64) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28710743 | 0.79 | MAPT (0.49) | TSHRMAPTMAPK1L3MBTL1CYP1A2 | |
| Trimethylammonium SCHEMBL28709702 | 0.77 | L3MBTL1 (0.49) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28710748 | 0.76 | MAPT (0.56) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28702764 | 0.76 | MAPT (0.56) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28709715 | 0.76 | MAPT (0.56) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28709705 | 0.76 | NFE2L2 (0.52) | MAPTMAPK1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL28710796 | 0.75 | ACHE (0.43) | TSHRACHEMAPTMAPK1L3MBTL1 | |
| Trimethylammonium SCHEMBL28701257 | 0.74 | MAPT (0.53) | TSHRMAPTMAPK1L3MBTL1CYP1A2 | |
| Trimethylammonium SCHEMBL28690443 | 0.74 | APP (0.56) | TSHRMAPTMAPK1L3MBTL1CYP1A2 |
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-114014879-A | Optically active biaryl borane adduct and preparation method and application thereof | 南开大学 | 2022-02-08 | — | — | CN | disclosed |