Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 2/20 | 0.30 |
| ▸ | MAOA | P21397 | 2/20 | 0.30 |
| ▸ | MAOB | P27338 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10033141 | 0.90 | ACHE (0.31) | ACHE | |
| SCHEMBL1709491 | 0.85 | KDM1A (0.42) | ACHEKDM1AMAOAMAOB | |
| SCHEMBL1709420 | 0.84 | SIGMAR1 (0.40) | KDM1AMAOAMAOB | |
| SCHEMBL10033004 | 0.83 | PSEN1 (0.36) | — | |
| SCHEMBL1709402 | 0.82 | HTR2C (0.34) | KDM1AMAOAMAOB | |
| SCHEMBL10032988 | 0.82 | KDM1A (0.33) | KDM1AMAOAMAOB | |
| SCHEMBL10033139 | 0.80 | SIGMAR1 (0.39) | KDM1AMAOAMAOB | |
| SCHEMBL1709450 | 0.78 | HTR2C (0.33) | KDM1AMAOAMAOB | |
| SCHEMBL10032822 | 0.78 | HTR2C (0.33) | KDM1AMAOAMAOB | |
| SCHEMBL10032995 | 0.77 | HTR2A (0.34) | ACHEKDM1AMAOAMAOB |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |