Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | CACNA2D1 | P54289 | 11/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28446266 | 0.85 | CACNA2D1 (0.39) | SLC7A5CACNA2D1SLC6A2TP53 | |
| SCHEMBL28457094 | 0.81 | SLC7A5 (0.43) | SLC7A5CACNA2D1SLC6A2 | |
| SCHEMBL28612875 | 0.79 | SLC6A4 (0.47) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22367302 | 0.78 | CACNA2D1 (0.45) | SLC7A5CACNA2D1SLC6A2ALDH1A1MAPT | |
| SCHEMBL22367306 | 0.78 | CACNA2D1 (0.45) | SLC7A5CACNA2D1SLC6A2ALDH1A1MAPT | |
| SCHEMBL22367305 | 0.78 | CACNA2D1 (0.49) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28449260 | 0.75 | CACNA2D1 (0.39) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28661250 | 0.73 | SLC7A5 (0.43) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28456934 | 0.72 | CACNA2D1 (0.39) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28453499 | 0.72 | CACNA2D1 (0.39) | SLC7A5CACNA2D1SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111566091-A | Novel alkoxyamino derivatives for the treatment of pain and pain related disorders | 埃斯特韦制药有限公司 | 2020-08-21 | — | — | CN | disclosed |