Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.39 |
| ▸ | ADH1C | P00326 | 3/20 | 0.39 |
| ▸ | ADH1A | P07327 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADH4 | P08319 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11280040 | 0.79 | ADH1B (0.37) | ADH1BADH1CADH1ATSHR | |
| SCHEMBL9470602 | 0.71 | — | — | |
| SCHEMBL11123961 | 0.71 | ADH1B (0.41) | ADH1BADH1CADH1ATSHRADH4 | |
| SCHEMBL10725876 | 0.70 | — | — | |
| SCHEMBL18801650 | 0.70 | ADH1B (0.32) | ADH1BADH1CADH1A | |
| SCHEMBL6179035 | 0.65 | ALDH1A1 (0.35) | TSHRALDH1A1 | |
| SCHEMBL19467 | 0.65 | — | — | |
| SCHEMBL8532399 | 0.65 | — | — | |
| SCHEMBL10572954 | 0.64 | ALDH1A1 (0.36) | ADH1BADH1CADH1ATSHRALDH1A1 | |
| SCHEMBL7670411 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0591040-B1 | Quaternary basic amides as tachykinines antagonists | SANOFI SA (FR) | 1999-02-03 | — | — | EP | disclosed |
| EP-0591040-A1 | Quaternary basic amides as tachykinines antagonists | SANOFI (FR) | 1994-04-06 | — | — | EP | disclosed |