Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.52 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | F7 | P08709 | 1/20 | 0.46 |
| ▸ | F3 | P13726 | 1/20 | 0.46 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.46 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5340218 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL9584867 | 0.78 | ALDH1A1 (0.57) | GAAALDH1A1APPHCAR3HCAR2 | |
| Hydrogen Peroxide SCHEMBL28248196 | 0.77 | ALDH1A1 (0.62) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL28119991 | 0.75 | ALDH1A1 (0.55) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL4198756 | 0.74 | ALDH1A1 (0.58) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL24202144 | 0.74 | ALDH1A1 (0.48) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL1687067 | 0.74 | ALDH1A1 (0.57) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL161322 | 0.74 | ALDH1A1 (0.59) | GAAALDH1A1APPHCAR3HCAR2 | |
| SCHEMBL31699264 | 0.74 | ALDH1A1 (0.59) | GAAALDH1A1APPHCAR3HCAR2 | |
| Niacin SCHEMBL27435596 | 0.74 | ALDH1A1 (0.84) | GAAALDH1A1APPHCAR3HCAR2 |
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-1028757-C | Heterocyclic derivatives, process for their preparation and their use as medicaments | SANOFI SA (FR) | 1995-06-07 | — | — | CN | disclosed |