Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3628274 | 0.78 | MAPK1 (0.39) | MAPK1 | |
| SCHEMBL5932522 | 0.74 | ALDH1A1 (0.42) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL8028711 | 0.72 | MAPK1 (0.43) | MAPK1 | |
| SCHEMBL13509577 | 0.71 | TSHR (0.46) | MAPK1ALDH1A1TSHR | |
| SCHEMBL14182577 | 0.71 | MAPK1 (0.41) | MAPK1ALDH1A1 | |
| SCHEMBL23337044 | 0.69 | — | — | |
| SCHEMBL19011981 | 0.69 | MAPK1 (0.48) | MAPK1 | |
| SCHEMBL7107029 | 0.69 | CYP2C19 (0.43) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL23096048 | 0.69 | MAPK1 (0.32) | MAPK1 | |
| SCHEMBL1739227 | 0.69 | MAPK1 (0.37) | MAPK1ALDH1A1 |
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-2009125808-A1 | AMINOCYCLOHEXYL DERIVATIVE | 第一三共株式会社 (JP) | 2009-10-15 | — | — | WO | disclosed |