Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL270073 | 0.80 | TSHR (0.41) | ALDH1A1TDP1TSHR | |
| SCHEMBL5793444 | 0.80 | TSHR (0.41) | ALDH1A1TDP1TSHR | |
| SCHEMBL17213414 | 0.79 | GABRR1 (0.37) | ALDH1A1TDP1 | |
| Acetic Acid SCHEMBL9655219 | 0.78 | FFAR3 (0.41) | ALDH1A1TDP1TSHR | |
| SCHEMBL425852 | 0.77 | — | — | |
| SCHEMBL822429 | 0.77 | — | — | |
| SCHEMBL10489503 | 0.77 | — | — | |
| SCHEMBL93407 | 0.77 | — | — | |
| SCHEMBL30033233 | 0.77 | — | — | |
| SCHEMBL26125123 | 0.77 | TDP1 (0.30) | ALDH1A1TDP1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2184061-A1 | Genariol as bacterial efflux pump inhibitor | Universite de Corse (FR) | 2010-05-12 | — | — | EP | disclosed |