Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 3/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | TACR1 | P25103 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | MC4R | P32245 | 2/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.31 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5137188 | 0.83 | SLC6A4 (0.55) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| SCHEMBL9598 | 0.81 | SLC6A4 (0.37) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| Oxalic Acid SCHEMBL9597 | 0.78 | SLC6A4 (0.50) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| SCHEMBL5137191 | 0.68 | SLC6A4 (0.32) | SLC6A4SLC6A2TACR1 | |
| SCHEMBL2487646 | 0.68 | SLC6A4 (0.64) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| Hydrochloric Acid SCHEMBL4018637 | 0.67 | SLC6A4 (0.62) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| Oxalic Acid SCHEMBL27272798 | 0.65 | SLC6A4 (0.42) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| SCHEMBL1535357 | 0.64 | SLC6A2 (0.69) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| SCHEMBL3470 | 0.64 | CACNA2D1 (0.52) | SLC6A4SLC6A2CACNA2D1SLC6A3HTR2A | |
| Acetic Acid SCHEMBL5302750 | 0.63 | SLC6A4 (0.38) | SLC6A4SLC6A2SLC6A3TACR1HTR1A |
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 |