Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3679186 | 0.76 | ALDH1A1 (0.47) | TDP1HSD17B10ALDH1A1TSHR | |
| SCHEMBL11600695 | 0.76 | ALDH1A1 (0.47) | TDP1HSD17B10ALDH1A1TSHR | |
| SCHEMBL11281390 | 0.72 | ALDH1A1 (0.43) | TDP1HSD17B10ALDH1A1TSHR | |
| SCHEMBL491228 | 0.69 | — | — | |
| SCHEMBL16907897 | 0.69 | — | — | |
| Methacrylic Acid SCHEMBL5685933 | 0.69 | ALDH1A1 (0.62) | TDP1HSD17B10ALDH1A1TSHR | |
| SCHEMBL21889680 | 0.69 | ALDH1A1 (0.35) | TDP1HSD17B10ALDH1A1TSHR | |
| SCHEMBL4908518 | 0.69 | — | — | |
| SCHEMBL24573 | 0.67 | — | — | |
| Acetaldehyde SCHEMBL1813490 | 0.67 | ALDH1A1 (0.71) | TDP1HSD17B10ALDH1A1TSHR |
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-2632460-B1 | THIOPHENE DERIVATIVES FOR USE IN THE TREATMENT OF TUBERCULOSIS | UNIV VIRGINIA PATENT FOUNDATION (US) | 2018-02-28 | — | — | EP | disclosed |