Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 17/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 17/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HRH1 | P35367 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | KLF10 | Q13118 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3282 | 0.94 | SLC2A1 (0.43) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL16834368 | 0.79 | SLC2A1 (0.41) | — | |
| SCHEMBL23521674 | 0.73 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL30788068 | 0.73 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL21742882 | 0.73 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| Cadaverine Tartrate SCHEMBL3757 | 0.71 | SLC6A4 (0.64) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL23521650 | 0.68 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL23521649 | 0.68 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL23761083 | 0.68 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL29975150 | 0.68 | SLC6A2 (0.50) | SLC6A4SLC6A2SLC6A3CYP1A2CYP3A4 |
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 |