Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 14/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.32 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18717726 | 0.70 | — | — | |
| SCHEMBL26605563 | 0.69 | — | — | |
| SCHEMBL21582005 | 0.69 | ADORA2A (0.36) | MAPTADORA2AADORA2B | |
| SCHEMBL25835823 | 0.64 | GAA (0.38) | ALDH1A1MAPTADORA2AADORA2B | |
| SCHEMBL18717725 | 0.64 | ADORA2A (0.33) | ADORA2AADORA2B | |
| SCHEMBL21236158 | 0.63 | ADORA2A (0.32) | ADORA2AADORA2B | |
| SCHEMBL21582003 | 0.61 | SMN1; SMN2 (0.38) | ALDH1A1MAPT | |
| SCHEMBL1872569 | 0.60 | IGLV6-57 (0.38) | CRHR1ALDH1A1ALDH3A1ALDH1A3 | |
| SCHEMBL31094892 | 0.59 | KDM4E (0.38) | ALDH1A1MAPT | |
| SCHEMBL15884995 | 0.58 | ALDH1A1 (0.33) | ALDH1A1ALDH3A1ALDH1A3 |
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-2980089-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2017-12-20 | — | — | EP | disclosed |