Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.65 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.65 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.65 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.65 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.65 |
| ▸ | SERPINE1 | P05121 | 5/20 | 0.54 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.45 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28411160 | 0.84 | MAPT (0.58) | ESR1 | |
| SCHEMBL4733780 | 0.83 | ESR1 (0.60) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4734869 | 0.83 | ESR1 (0.60) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4735640 | 0.83 | ESR1 (0.60) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4735045 | 0.83 | ESR1 (0.60) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL5373240 | 0.82 | MAPT (0.59) | ESR1 | |
| SCHEMBL4735692 | 0.81 | ESR1 (0.57) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4735013 | 0.81 | SERPINE1 (0.51) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL22471819 | 0.81 | ESR1 (0.45) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL22471804 | 0.81 | ESR1 (0.45) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 |
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 |