Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL2631 | 0.90 | ALDH1A1 (0.48) | SLC6A4SLC6A2SLC6A3HRH3ALDH1A1 | |
| Fumaric Acid SCHEMBL2633 | 0.90 | ALDH1A1 (0.48) | SLC6A4SLC6A2SLC6A3HRH3ALDH1A1 | |
| SCHEMBL11239618 | 0.74 | SLC6A4 (0.68) | SLC6A4SLC6A2HRH3SLC6A9 | |
| SCHEMBL2632 | 0.74 | SLC6A2 (0.43) | SLC6A4SLC6A2SLC6A3ALDH1A1MAPT | |
| SCHEMBL5080333 | 0.73 | CACNA2D1 (0.57) | SLC6A4SLC6A2 | |
| Iodide SCHEMBL2607 | 0.72 | CACNA2D1 (0.56) | SLC6A4SLC6A2 | |
| SCHEMBL7158810 | 0.72 | SLC6A4 (0.73) | SLC6A4SLC6A2HRH3SLC6A9 | |
| SCHEMBL12620670 | 0.71 | SLC6A4 (0.50) | SLC6A4HRH3SLC6A9 | |
| SCHEMBL15809601 | 0.70 | SLC6A4 (0.62) | SLC6A4SLC6A2HRH3SLC6A9 | |
| Fumaric Acid SCHEMBL5313492 | 0.70 | SLC6A2 (0.44) | SLC6A4SLC6A2SLC6A3ALDH1A1MAPT |
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-2008133884-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-11-06 | — | — | WO | disclosed |