Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.62 |
| ▸ | TYR | P14679 | 3/20 | 0.62 |
| ▸ | SERPINE1 | P05121 | 4/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.56 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.56 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.56 |
| ▸ | PRKCG | P05129 | 1/20 | 0.52 |
| ▸ | PRKCB | P05771 | 1/20 | 0.52 |
| ▸ | PRKCA | P17252 | 1/20 | 0.52 |
| ▸ | PRKACA | P17612 | 1/20 | 0.52 |
| ▸ | PRKACG | P22612 | 1/20 | 0.52 |
| ▸ | PRKACB | P22694 | 1/20 | 0.52 |
| ▸ | PRKCH | P24723 | 1/20 | 0.52 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735890 | 0.83 | L3MBTL1 (0.83) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| SCHEMBL4738037 | 0.79 | L3MBTL1 (0.81) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| Hexyl Gallate SCHEMBL15388153 | 0.78 | ESR1 (0.75) | ESR1TYRSERPINE1SMN1; SMN2AKR1C4 | |
| SCHEMBL4731853 | 0.78 | L3MBTL1 (0.78) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| Butyl Gallate SCHEMBL35913 | 0.78 | ESR1 (1.00) | ESR1SERPINE1SMN1; SMN2AKR1C4AKR1C3 | |
| SCHEMBL9838369 | 0.77 | TYR (0.78) | ESR1TYRSERPINE1NPC1MAPT | |
| SCHEMBL7775753 | 0.77 | SERPINE1 (1.00) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| SCHEMBL13287172 | 0.77 | SERPINE1 (0.92) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| SCHEMBL2791373 | 0.77 | SERPINE1 (1.00) | ESR1TYRSERPINE1L3MBTL1AKR1C4 | |
| SCHEMBL4738028 | 0.77 | TYR (1.00) | ESR1TYRSERPINE1NPC1MAPT |
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-2008065527-A2 | GALLIC ACID ESTERS OF FRAGRANT ALCOHOLS | GHISALBERTI CARLO (BR) | 2008-06-05 | — | — | WO | disclosed |