Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 19/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 18/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3364481 | 0.86 | SLC6A4 (0.80) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL7954484 | 0.84 | SLC6A2 (0.56) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL7953051 | 0.82 | SLC6A4 (0.54) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL12205535 | 0.77 | SLC6A4 (0.51) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL12035612 | 0.75 | MEN1 (0.68) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL6246873 | 0.74 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL6246875 | 0.74 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL6246871 | 0.74 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3MEN1NPC1 | |
| SCHEMBL7955308 | 0.74 | ALDH1A1 (0.49) | SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6 | |
| SCHEMBL13443601 | 0.71 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3MEN1NPC1 |
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-2010021681-A2 | COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES | COMBINATORX (SINGAPORE) PTE. LTD. (SG) | 2010-02-25 | — | — | WO | disclosed |