Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | NPY2R | P49146 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16735812 | 1.00 | ALDH1A1 (0.44) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL18053692 | 0.85 | ALDH1A1 (0.40) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL1028886 | 0.84 | L3MBTL1 (0.49) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL1028889 | 0.84 | L3MBTL1 (0.49) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL3509381 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL3509375 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL2209281 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HTTL3MBTL1MAPTTDP1 | |
| SCHEMBL2209277 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HTTL3MBTL1MAPTTDP1 | |
| SCHEMBL1026260 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HTTTP53L3MBTL1MAPT | |
| SCHEMBL1026262 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HTTTP53L3MBTL1MAPT |
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-2015143376-A1 | NOVEL COMPOUNDS FOR THE TREATMENT OF CYSTIC FIBROSIS | NIVALIS THERAPEUTICS, INC. (US) | 2015-09-24 | — | — | WO | disclosed |