Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL27636521 | 0.96 | SLC22A1 (0.46) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL28314916 | 0.81 | SLC22A1 (0.43) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL28864079 | 0.79 | SLC22A1 (0.50) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL28223332 | 0.79 | SLC22A1 (0.80) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL5270023 | 0.79 | SLC22A1 (0.80) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL11246970 | 0.78 | SLC22A1 (0.55) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL3296432 | 0.78 | SLC22A1 (0.60) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL623145 | 0.77 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL887137 | 0.77 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 | |
| Tetrabuthylammonium SCHEMBL2976678 | 0.77 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3178811-B1 | A PROCESS FOR THE SYNTHESIS OF SULFONES AND SULFONAMIDES | COMMISSARIAT ENERGIE ATOMIQUE (FR) | 2018-10-31 | — | — | EP | claimed |