Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4346283 | 0.94 | ALDH1A1 (0.49) | ALDH1A1SLC6A3PTPN7MAPTKDM4E | |
| SCHEMBL4354492 | 0.89 | EPHX1 (0.55) | ALDH1A1EPHX2EPHX1SLC6A3MAPT | |
| SCHEMBL8598927 | 0.88 | EPHX1 (0.57) | ALDH1A1EPHX2EPHX1SLC6A3MAPT | |
| SCHEMBL8601321 | 0.88 | EPHX1 (0.57) | ALDH1A1EPHX2EPHX1SLC6A3MAPT | |
| SCHEMBL27782790 | 0.86 | EPHX1 (0.50) | ALDH1A1EPHX2EPHX1SLC6A3MAPT | |
| SCHEMBL4356323 | 0.77 | SMN1; SMN2 (0.62) | ALDH1A1MAPTHTT | |
| SCHEMBL6229381 | 0.76 | ALDH1A1 (0.54) | ALDH1A1EPHX2EPHX1MAPTKDM4E | |
| SCHEMBL4358300 | 0.76 | ALDH1A1 (0.52) | ALDH1A1EPHX2PTPN7MAPTKDM4E | |
| SCHEMBL4359582 | 0.76 | ALDH1A1 (0.52) | ALDH1A1EPHX2PTPN7MAPTKDM4E | |
| SCHEMBL6225668 | 0.76 | ALDH1A1 (0.55) | ALDH1A1EPHX2EPHX1PTPN7MAPT |
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-2004030664-A2 | NEW COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2004-04-15 | — | — | WO | claimed |