Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 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 | |
|---|---|---|---|---|
| SCHEMBL2450670 | 0.91 | — | — | |
| SCHEMBL28850383 | 0.89 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL142284 | 0.80 | — | — | |
| SCHEMBL701871 | 0.73 | — | — | |
| SCHEMBL29962604 | 0.73 | TSHR (0.43) | CA1CA9ALDH1A1TRIM24TRIM33 | |
| SCHEMBL29962055 | 0.73 | TSHR (0.43) | CA1CA9ALDH1A1TRIM24TRIM33 | |
| SCHEMBL29962516 | 0.73 | TSHR (0.43) | CA1CA9ALDH1A1TRIM24TRIM33 | |
| SCHEMBL29962253 | 0.73 | TSHR (0.43) | CA1CA9ALDH1A1TRIM24TRIM33 | |
| Methoxymethane SCHEMBL8952224 | 0.73 | — | — | |
| SCHEMBL29962242 | 0.73 | TSHR (0.43) | CA1CA9ALDH1A1TRIM24TRIM33 |
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-0889945-A1 | FRAGRANT MACROCYCLIC LACTONES | FIRMENICH SA (CH) | 1999-01-13 | — | — | EP | disclosed |
| WO-1997032948-A1 | FRAGRANT MACROCYCLIC LACTONES | FIRMENICH S.A. (CH) | 1997-09-12 | — | — | WO | disclosed |