Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A1 | P43005 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7819092 | 0.80 | SLC1A3 (0.43) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL2269233 | 0.77 | SLC1A3 (0.49) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL29277743 | 0.74 | SLC6A2 (0.50) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL29277741 | 0.74 | SLC6A2 (0.50) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL8508888 | 0.72 | ALDH1A1 (0.50) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL11094947 | 0.71 | SLC1A3 (0.53) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL27857348 | 0.71 | SLC1A3 (0.53) | SLC1A1KMT2ASLC1A3SLC1A2CYP1A2 | |
| SCHEMBL6963343 | 0.71 | ALDH1A1 (0.49) | KMT2AALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL12935748 | 0.71 | ALDH1A1 (0.49) | KMT2AALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL669496 | 0.70 | CYP2D6 (0.41) | CYP2D6SMN1; SMN2ALDH1A1MAPK1 |
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-1078919-A1 | SYNTHESIS OF $g(a)-AMINO-$g(a)',$g(a)'-DIHALOKETONES AND PROCESS FOR THE PREPARATION OF $g(b)-AMINO ACID DERIVATIVES BY THE USE OF THE SAME | KANEKA CORPORATION (JP) | 2001-02-28 | — | — | EP | disclosed |