Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL1883912 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL27979089 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL22689858 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL4252976 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL2023167 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL27885548 | 1.00 | ACHE (0.37) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL6550021 | 0.96 | ACHE (0.39) | ACHETSHRALDH1A1HSD17B10TDP1 | |
| Trimethylammonium SCHEMBL303395 | 0.87 | — | — | |
| Trimethylammonium SCHEMBL25438207 | 0.87 | TSHR (0.50) | TSHRALDH1A1HSD17B10 | |
| Trimethylammonium SCHEMBL1263576 | 0.87 | TSHR (0.50) | TSHRALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7947854-B2 | Phospholipase inhibitor; prevention or therapy of microbial infection; bactericides; fungicides; viricides; parasiticides; using quaternary or phosphonium group containing compounds | THE UNIVERSITY OF SYDNEY (AU) | 2011-05-24 | — | — | US | disclosed |