Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1894209 | 0.83 | ACHE (0.44) | ACHE | |
| SCHEMBL13626516 | 0.81 | AGTR1 (0.33) | ACHEAGTR1APLNR | |
| SCHEMBL9848891 | 0.77 | ACHE (0.45) | ACHE | |
| SCHEMBL27771431 | 0.76 | CYP19A1 (0.39) | — | |
| SCHEMBL13625938 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL13625877 | 0.75 | APLNR (0.33) | ACHEAGTR1APLNR | |
| SCHEMBL9848919 | 0.75 | ACHE (0.46) | ACHE | |
| SCHEMBL9848904 | 0.73 | ACHE (0.42) | ACHE | |
| SCHEMBL1894688 | 0.73 | GAA (0.43) | ACHE | |
| SCHEMBL14095791 | 0.73 | AGTR1 (0.44) | ACHEAGTR1 |
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-2009133970-A1 | CRYSTALLINE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-05 | — | — | WO | disclosed |