Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.70 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.65 |
| ▸ | CACNA2D1 | P54289 | 9/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | MTOR | P42345 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | THPO | P40225 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL3751 | 0.92 | SLC6A4 (0.60) | SLC6A4SLC6A2CACNA2D1NPC1CYP2D6 | |
| SCHEMBL5011928 | 0.83 | SLC6A4 (1.00) | SLC6A4SLC6A2NPC1CYP2D6CYP2C19 | |
| SCHEMBL8197696 | 0.83 | SLC6A4 (1.00) | SLC6A4SLC6A2NPC1CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL4941345 | 0.82 | SLC6A4 (0.97) | SLC6A4SLC6A2NPC1CYP2D6CYP2C19 | |
| Oxalic Acid SCHEMBL3980 | 0.80 | SLC6A4 (0.64) | SLC6A4SLC6A2CACNA2D1NPC1CYP2D6 | |
| SCHEMBL3359634 | 0.79 | SLC6A4 (1.00) | SLC6A4SLC6A2CACNA2D1CYP2D6CYP2C19 | |
| SCHEMBL3967638 | 0.79 | SLC6A4 (1.00) | SLC6A4SLC6A2CACNA2D1CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL4413256 | 0.78 | SLC6A4 (0.98) | SLC6A4SLC6A2CACNA2D1CYP2D6CYP2C19 | |
| Succinic Acid SCHEMBL4387 | 0.76 | SLC6A2 (0.60) | SLC6A4SLC6A2CACNA2D1CYP2D6CYP2C19 | |
| Oxalic Acid SCHEMBL3448 | 0.76 | SLC6A4 (0.87) | SLC6A4SLC6A2CACNA2D1CYP2D6CYP2C19 |
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 |