Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 8/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL7811924 | 0.90 | HTT (0.56) | HTTMAPTTDP1ALDH3A1POLB | |
| SCHEMBL2334056 | 0.85 | HTT (0.72) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL3440916 | 0.84 | HCAR3 (0.57) | HTTMAPTPKMALDH1A1KMT2A | |
| SCHEMBL7101559 | 0.84 | HTT (0.70) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL12426042 | 0.83 | HTT (0.82) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL10802959 | 0.83 | HTT (0.68) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL1496476 | 0.82 | ALDH1A1 (0.55) | HTTMAPTPKMALDH1A1KMT2A | |
| SCHEMBL13043458 | 0.81 | HTT (0.65) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL13043696 | 0.80 | HTT (0.64) | HTTMAPTTDP1ALDH3A1PKM | |
| SCHEMBL5881710 | 0.80 | HTT (0.64) | HTTMAPTTDP1ALDH3A1PKM |
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-2011023722-A1 | NOVEL QUINOXALINONE HEPCIDIN ANTAGONISTS | VIFOR (INTERNATIONAL) AG (CH) | 2011-03-03 | — | — | WO | disclosed |