Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9803955 | 0.83 | — | — | |
| SCHEMBL26436015 | 0.82 | JAK2 (0.34) | HRH3 | |
| SCHEMBL29646200 | 0.75 | GAA (0.33) | — | |
| SCHEMBL18885236 | 0.75 | GAA (0.33) | — | |
| SCHEMBL27281638 | 0.75 | GAA (0.33) | — | |
| SCHEMBL18912354 | 0.75 | ALDH1A1 (0.35) | ALDH1A1PKMPOLBSMN1; SMN2 | |
| SCHEMBL13349537 | 0.74 | HRH3 (0.57) | POLBHRH3 | |
| SCHEMBL16604390 | 0.73 | HRH3 (0.51) | ALDH1A1POLBHRH3 | |
| SCHEMBL81698 | 0.73 | SIGMAR1 (0.39) | — | |
| SCHEMBL12568602 | 0.73 | SIGMAR1 (0.39) | — |
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-2017088755-A1 | AMINOPYRIMIDINE HETEROCYCLIC COMPOUND WITH ADENOSINE RECEPTOR ANTAGONISTIC ACTIVITY | Suzhou Yunxuan Yiyao Keji Youxian Gongsi (CN) | 2017-06-01 | — | — | WO | disclosed |