Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.62 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.62 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.62 |
| ▸ | PDE5A | O76074 | 4/20 | 0.56 |
| ▸ | PDE1A | P54750 | 3/20 | 0.56 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.56 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.53 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.52 |
| ▸ | PDE2A | O00408 | 2/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11069848 | 0.88 | SIRT1 (0.51) | SIRT1SIRT3SIRT5PDE5APDE1A | |
| SCHEMBL4623940 | 0.87 | PDE1A (0.55) | SIRT1SIRT3SIRT5PDE5APDE1A | |
| SCHEMBL11066985 | 0.82 | SIRT1 (0.54) | SIRT1SIRT3SIRT5ADORA2BADORA2A | |
| SCHEMBL7424268 | 0.80 | SIRT1 (0.50) | SIRT1SIRT3SIRT5CYP1A2CYP3A4 | |
| SCHEMBL11066982 | 0.80 | SIRT1 (0.45) | SIRT1SIRT3SIRT5CYP1A2CYP3A4 | |
| SCHEMBL7477209 | 0.77 | SIRT1 (0.41) | SIRT1SIRT3SIRT5PDE5APDE1A | |
| SCHEMBL4796596 | 0.77 | PDE1A (0.46) | SIRT1SIRT3SIRT5PDE5APDE1A | |
| SCHEMBL3399015 | 0.77 | SIRT1 (0.61) | SIRT1SIRT3SIRT5CYP1A2CYP3A4 | |
| SCHEMBL2917587 | 0.77 | PDE1A (0.78) | SIRT1SIRT3SIRT5PDE5APDE1A | |
| SCHEMBL3394252 | 0.77 | SIRT1 (0.61) | SIRT1SIRT3SIRT5CYP1A2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1289510-A2 | COMPOSITIONS, KITS, AND METHODS FOR PROMOTING DEFINED HEALTH BENEFITS | THE PROCTER & GAMBLE COMPANY (US) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001093847-A2 | COMPOSITIONS, KITS, AND METHODS FOR PROMOTING DEFINED HEALTH BENEFITS | THE PROCTER & GAMBLE COMPANY (US) | 2001-12-13 | — | — | WO | disclosed |