Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.49 |
| ▸ | PGR | P06401 | 3/20 | 0.48 |
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.47 |
| ▸ | CCR2 | P41597 | 2/20 | 0.46 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.46 |
| ▸ | ACLY | P53396 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29561195 | 0.90 | SIRT6 (0.49) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561551 | 0.87 | MAPT (0.52) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561466 | 0.81 | PGR (0.57) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561662 | 0.81 | PKM (0.53) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561664 | 0.81 | PGR (0.52) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29562488 | 0.80 | SIRT6 (0.71) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561437 | 0.80 | PGR (0.69) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29562114 | 0.79 | MAPT (0.66) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561400 | 0.78 | ALDH1A1 (0.71) | CES1CYP3A4PSEN1PSEN2APH1B | |
| SCHEMBL29561444 | 0.78 | CES1 (0.81) | CES1CYP3A4PSEN1PSEN2APH1B |
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 |
|---|---|---|---|---|---|---|---|
| CN-109384694-B | SIRT6 small-molecule agonist and application thereof | 上海爱乐维生物科技有限公司 | 2022-04-05 | — | — | CN | disclosed |