Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 7/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RARA | P10276 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11061443 | 1.00 | RARB (0.47) | RARBMEN1ALDH1A1RARAMAPT | |
| SCHEMBL11064458 | 0.96 | DRD2 (0.46) | ALDH1A1MAPTFDFT1DRD2DRD3 | |
| SCHEMBL11064456 | 0.96 | DRD2 (0.46) | ALDH1A1MAPTFDFT1DRD2DRD3 | |
| SCHEMBL11061568 | 0.95 | DRD2 (0.45) | RARBMEN1ALDH1A1RARAMAPT | |
| SCHEMBL11068889 | 0.95 | DRD2 (0.45) | RARBMEN1ALDH1A1RARAMAPT | |
| SCHEMBL11061580 | 0.95 | DRD2 (0.45) | RARBMEN1ALDH1A1RARAMAPT | |
| SCHEMBL11068885 | 0.95 | DRD2 (0.45) | RARBMEN1ALDH1A1RARAMAPT | |
| SCHEMBL10623278 | 0.93 | DRD2 (0.43) | ALDH1A1MAPTFDFT1DRD2DRD3 | |
| SCHEMBL11061929 | 0.92 | DRD2 (0.47) | FDFT1DRD2DRD3RAB9ACA12 | |
| SCHEMBL11061908 | 0.92 | DRD2 (0.47) | FDFT1DRD2DRD3RAB9ACA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4439015-A | Disubstituted ethanes | HOFFMANN-LA ROCHE INC. (US) | 1984-03-27 | — | — | US | disclosed |