Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.62 |
| ▸ | CA1 | P00915 | 4/20 | 0.62 |
| ▸ | CA2 | P00918 | 4/20 | 0.62 |
| ▸ | CA7 | P43166 | 4/20 | 0.62 |
| ▸ | CA9 | Q16790 | 4/20 | 0.62 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.62 |
| ▸ | SERPINE1 | P05121 | 5/20 | 0.59 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 3/20 | 0.58 |
| ▸ | TYR | P14679 | 2/20 | 0.56 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.55 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Ethylgallate SCHEMBL39599 | 0.91 | SERPINE1 (0.70) | CA12CA1CA2CA7CA9 | |
| Ethylgallate SCHEMBL27840060 | 0.89 | SERPINE1 (0.68) | CA12CA1CA2CA7CA9 | |
| Ethylgallate SCHEMBL29200753 | 0.87 | SERPINE1 (0.66) | CA12CA1CA2CA7CA9 | |
| Ethylgallate SCHEMBL29200784 | 0.87 | SERPINE1 (0.66) | CA12CA1CA2CA7CA9 | |
| Propyl Gallate SCHEMBL186140 | 0.87 | ESR1 (0.69) | SERPINE1ESR1TYRAKR1C4AKR1C3 | |
| Ethylgallate SCHEMBL28018664 | 0.86 | SERPINE1 (0.63) | CA12CA1CA2CA7CA9 | |
| Ethylgallate SCHEMBL26626292 | 0.84 | SERPINE1 (0.61) | CA12CA1CA2CA7CA9 | |
| Ethylgallate SCHEMBL3716520 | 0.84 | KDM4E (0.75) | CA12CA1CA2CA7CA9 | |
| Propyl Gallate SCHEMBL9232748 | 0.83 | ESR1 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15044101 | 0.82 | CA12 (0.61) | CA12CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001014510-A1 | STRIPPING AND CLEANING COMPOSITIONS | ASHLAND INC. (US) | 2001-03-01 | — | — | WO | disclosed |