Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3390773 | 0.92 | HSD17B10 (0.36) | HSD17B10TSHR | |
| SCHEMBL2123433 | 0.89 | ALDH1A1 (0.45) | ALDH1A1TSHR | |
| SCHEMBL18506581 | 0.86 | HSD17B10 (0.33) | HSD17B10 | |
| SCHEMBL2473861 | 0.83 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL12456984 | 0.81 | HTT (0.48) | ALDH1A1TSHR | |
| SCHEMBL12456981 | 0.81 | HTT (0.48) | ALDH1A1TSHR | |
| Ether SCHEMBL25432425 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL11970063 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL11970056 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL272689 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TSHR |
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-0026004-B1 | LIQUID CRYSTALS MIXTURE | BBC Aktiengesellschaft Brown, Boveri & Cie. (CH) | 1983-05-18 | — | — | EP | disclosed |