Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | MAX | P61244 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2194289 | 0.85 | ALDH1A1 (0.46) | ALDH1A1MYCMAXEPHX2PTK2 | |
| SCHEMBL12335645 | 0.77 | ALDH1A1 (0.40) | ALDH1A1MYCMAXEPHX2PTK2 | |
| SCHEMBL2572184 | 0.76 | GSK3B (0.58) | ALDH1A1MYCAURKAMEN1KMT2A | |
| SCHEMBL18077187 | 0.76 | ALDH1A1 (0.33) | ALDH1A1MYCMAXMEN1KMT2A | |
| SCHEMBL2464808 | 0.75 | KIF11 (0.54) | FGFR4AURKAAKR1B1AKR1C4AKR1C3 | |
| SCHEMBL18077243 | 0.75 | PRKCQ (0.33) | ALDH1A1MYCMAXPTK2MEN1 | |
| SCHEMBL20529668 | 0.74 | MAPT (0.42) | ALDH1A1FGFR4MEN1KMT2AMAPT | |
| SCHEMBL20089577 | 0.74 | ALDH1A1 (0.32) | ALDH1A1MYCMAXPRKCQ | |
| SCHEMBL18077191 | 0.73 | ALDH1A1 (0.33) | ALDH1A1MYCMAXMAPTSMN1; SMN2 | |
| SCHEMBL18077190 | 0.72 | ALDH1A1 (0.32) | ALDH1A1MYCMAXMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011116176-A1 | 3-SUBSTITUED IMIDAZO (4, 5-B) PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS INC. (US) | 2011-09-22 | — | — | WO | disclosed |
| WO-2011116176-A1 | 3-SUBSTITUED IMIDAZO (4, 5-B) PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS INC. (US) | 2011-09-22 | — | — | WO | disclosed |