Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 6/20 | 0.44 |
| ▸ | ELANE | P08246 | 11/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | BIRC3 | Q13489 | 2/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2208704 | 1.00 | XIAP (0.44) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2208710 | 1.00 | XIAP (0.44) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2212677 | 0.91 | XIAP (0.45) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2212678 | 0.91 | XIAP (0.45) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2212463 | 0.91 | XIAP (0.45) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2317890 | 0.89 | XIAP (0.47) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2317902 | 0.89 | XIAP (0.47) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2317891 | 0.89 | XIAP (0.47) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2212840 | 0.86 | XIAP (0.43) | XIAPELANEALDH1A1XBP1HTT | |
| SCHEMBL2211105 | 0.86 | XIAP (0.43) | XIAPELANEALDH1A1XBP1HTT |
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-2099769-B1 | 6-OXO.-1, 6-DIHYDROPYRIMIDIN-2-YLS IN THE TREATMENT OF PROLIFERATIVE DISEASES | NOVARTIS AG (CH) | 2011-07-27 | — | — | EP | disclosed |