Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.65 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.65 |
| ▸ | CA4 | P22748 | 2/20 | 0.65 |
| ▸ | CA1 | P00915 | 3/20 | 0.58 |
| ▸ | CA2 | P00918 | 3/20 | 0.58 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | CA3 | P07451 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | APP | P05067 | 2/20 | 0.58 |
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.54 |
| ▸ | BAX | Q07812 | 1/20 | 0.54 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.54 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Mequinol SCHEMBL9484363 | 0.97 | LTA4H (0.70) | LTA4HESR2CA4CA1CA2 | |
| Anisole SCHEMBL28207979 | 0.95 | CA4 (0.74) | LTA4HESR2CA4CA1CA2 | |
| Anisole SCHEMBL2875269 | 0.95 | CA4 (0.74) | LTA4HESR2CA4CA1CA2 | |
| Anisole SCHEMBL28231688 | 0.92 | CA4 (0.70) | LTA4HESR2CA4CA1CA2 | |
| Phenol SCHEMBL27693639 | 0.91 | ACHE (0.65) | LTA4HESR2CA4CA1CA2 | |
| Biphenyl SCHEMBL28073296 | 0.88 | ESR2 (0.78) | LTA4HESR2CA4APPBACE1 | |
| SCHEMBL5190092 | 0.86 | ESR2 (0.83) | LTA4HESR2CA4TDP1APP | |
| Mequinol SCHEMBL28799186 | 0.86 | LTA4H (0.61) | LTA4HESR2CA4CA1CA2 | |
| Mequinol SCHEMBL166535 | 0.86 | ESR2 (0.84) | LTA4HESR2CA1CA2CA12 | |
| Mequinol SCHEMBL21009 | 0.86 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107432497-A | A kind of function essence for being applied to heating non-combustion-type tobacco product | 浙江中烟工业有限责任公司 | 2017-12-05 | — | — | CN | claimed |
| CN-107432497-A | A kind of function essence for being applied to heating non-combustion-type tobacco product | 浙江中烟工业有限责任公司 | 2017-12-05 | — | — | CN | disclosed |
| CN-107432497-A | A kind of function essence for being applied to heating non-combustion-type tobacco product | 浙江中烟工业有限责任公司 | 2017-12-05 | — | — | CN | disclosed |
| CN-107432496-A | One kind is applied to heating non-combustion-type tobacco product and its perfuming method | 浙江中烟工业有限责任公司 | 2017-12-05 | — | — | CN | disclosed |
| CN-107432496-A | One kind is applied to heating non-combustion-type tobacco product and its perfuming method | 浙江中烟工业有限责任公司 | 2017-12-05 | — | — | CN | disclosed |
| CN-101044156-A | Novel enzymatic substrates derived from phenoxazinone and their use as developer in detection of micro-organism with peptidase activity | BIOMERIEUX SA (FR) | 2007-09-26 | — | — | CN | disclosed |