Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17793485 | 0.87 | ALDH1A1 (0.48) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL30171067 | 0.85 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ANPC1MAPT | |
| SCHEMBL29001528 | 0.85 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ANPC1MAPT | |
| SCHEMBL17793483 | 0.84 | ALDH1A1 (0.46) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL17793516 | 0.83 | HSP90AA1 (0.45) | ALDH1A1MEN1KMT2ANPC1MAPT | |
| SCHEMBL2951117 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL17793482 | 0.83 | ALDH1A1 (0.45) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL17793481 | 0.82 | ALDH1A1 (0.42) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL17793417 | 0.82 | MAPK1 (0.42) | ALDH1A1HTTPOLBRXFP1KDM4E | |
| SCHEMBL2951107 | 0.79 | ALDH1A1 (0.64) | ALDH1A1HTTPOLBRXFP1KDM4E |
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-2016086022-A2 | HETEROAROMATIC IMIDAZOLYL COMPOUNDS AND METHODS FOR TREATING CANCER | CHANNEL THERAPEUTICS, INC. (US) | 2016-06-02 | — | — | WO | disclosed |