Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 8/20 | 0.44 |
| ▸ | RCOR1 | Q9UKL0 | 4/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 6/20 | 0.33 |
| ▸ | MAOB | P27338 | 6/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | CTSE | P14091 | 1/20 | 0.32 |
| ▸ | PGC | P20142 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3710752 | 1.00 | KDM1A (0.44) | KDM1ARCOR1HTR3AMAOAMAOB | |
| SCHEMBL1439732 | 0.88 | KDM1A (0.46) | KDM1ARCOR1MAOAMAOBSLC6A3 | |
| SCHEMBL3708877 | 0.85 | SLC6A2 (0.35) | KDM1ARCOR1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3715880 | 0.85 | KDM1A (0.42) | KDM1ARCOR1HTR3AMAOAMAOB | |
| SCHEMBL3714347 | 0.82 | KDM1A (0.48) | KDM1ARCOR1HTR3AMAOAMAOB | |
| SCHEMBL3712746 | 0.82 | KDM1A (0.45) | KDM1ARCOR1HTR3AMAOAMAOB | |
| SCHEMBL3715321 | 0.82 | KDM1A (0.45) | KDM1ARCOR1HTR3AMAOAMAOB | |
| SCHEMBL3644402 | 0.76 | KDM1A (0.46) | KDM1ARCOR1MAOAMAOB | |
| SCHEMBL3712361 | 0.75 | KDM1A (0.38) | KDM1ARCOR1SLC6A4REN | |
| SCHEMBL2225021 | 0.74 | KDM1A (0.52) | KDM1ARCOR1MAOAMAOBSLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2391615-A1 | Piperidine derivatives as nk3 receptor antagonists | F. Hoffmann-La Roche AG (CH) | 2011-12-07 | — | — | EP | disclosed |
| WO-2010086259-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-08-05 | — | — | WO | disclosed |