Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 10/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9070614 | 0.79 | LMNA (0.35) | ALDH1A1NPBWR1SMN1; SMN2MCHR1 | |
| SCHEMBL9229804 | 0.76 | SMN1; SMN2 (0.35) | PKMALDH1A1NPBWR1SMN1; SMN2MCHR1 | |
| SCHEMBL14572025 | 0.75 | TRPA1 (0.45) | ARMAOAMAOBPKMALDH1A1 | |
| SCHEMBL23811255 | 0.74 | MAOA (0.36) | ARMAOAMAOBPKMALDH1A1 | |
| SCHEMBL16960129 | 0.72 | AR (0.38) | ARMAOAMAOBPKMALDH1A1 | |
| SCHEMBL15355230 | 0.72 | MAPT (0.36) | ALDH1A1NPBWR1SMN1; SMN2MCHR1HPGD | |
| SCHEMBL13199463 | 0.71 | AR (0.45) | ARALDH1A1HPGD | |
| SCHEMBL12180531 | 0.71 | ALDH1A1 (0.51) | ARALDH1A1HPGD | |
| SCHEMBL15899607 | 0.71 | ALDH1A1 (0.39) | ALDH1A1NPBWR1SMN1; SMN2MCHR1 | |
| SCHEMBL8295646 | 0.71 | POLB (0.34) | ALDH1A1NPBWR1SMN1; SMN2MCHR1HPGD |
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-2017170765-A1 | NOVEL NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | 田辺三菱製薬株式会社 | 2017-10-05 | — | — | WO | disclosed |