Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | CD44 | P16070 | 1/20 | 0.48 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.38 |
| ▸ | TSHR | P16473 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15797869 | 0.86 | GAA (0.58) | GAACD44CYP3A4TSHRALDH1A1 | |
| SCHEMBL15060714 | 0.86 | GAA (0.43) | GAACD44PTK2CYP3A4TSHR | |
| SCHEMBL6094188 | 0.86 | GAA (0.67) | GAACD44CYP3A4TSHRALDH1A1 | |
| SCHEMBL9556486 | 0.79 | GAA (0.43) | GAACD44CYP3A4TSHRALDH1A1 | |
| SCHEMBL9523992 | 0.79 | CD44 (0.52) | GAACD44CYP3A4TSHRALDH1A1 | |
| SCHEMBL7798913 | 0.79 | GAA (0.38) | GAACD44CYP3A4TSHRALDH1A1 | |
| SCHEMBL4306430 | 0.77 | CYP3A4 (0.35) | GAACYP3A4TSHRALDH1A1TP53 | |
| SCHEMBL29534050 | 0.77 | GAA (0.71) | GAACD44PTK2CYP3A4TSHR | |
| SCHEMBL203217 | 0.77 | GAA (0.71) | GAACD44PTK2CYP3A4TSHR | |
| SCHEMBL5312236 | 0.77 | GAA (0.53) | GAACD44PTK2CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5374639-A | Plant fungicides | CIBA-GEIGY CORPORATION (US) | 1994-12-20 | — | — | US | disclosed |
| EP-0549532-A1 | Benzotriazole-sulfonic acid derivatives and their use as microbicides | CIBA-GEIGY AG (CH) | 1993-06-30 | — | — | EP | disclosed |