Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | APLNR | P35414 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9567005 | 1.00 | AOC3 (0.39) | AOC3SLC6A2SLC6A4NPSR1ALDH1A1 | |
| SCHEMBL9181124 | 0.86 | ADRB2 (0.39) | AOC3NPSR1ALDH1A1TSHRMAPK1 | |
| SCHEMBL9181120 | 0.86 | ADRB2 (0.39) | AOC3NPSR1ALDH1A1TSHRMAPK1 | |
| SCHEMBL19096193 | 0.83 | CA2 (0.35) | APLNR | |
| SCHEMBL9563491 | 0.83 | TAAR1 (0.43) | SLC6A2SLC6A4ALDH1A1TSHRMAPK1 | |
| SCHEMBL9563493 | 0.83 | TAAR1 (0.43) | SLC6A2SLC6A4ALDH1A1TSHRMAPK1 | |
| SCHEMBL17318172 | 0.81 | CA2 (0.34) | ALDH1A1APLNRLMNACYP3A4 | |
| SCHEMBL20630775 | 0.77 | AOC3 (0.54) | AOC3SLC6A2SLC6A4NPSR1ALDH1A1 | |
| SCHEMBL334107 | 0.76 | PKM (0.37) | AOC3NPSR1ALDH1A1TSHRMAPK1 | |
| SCHEMBL16900479 | 0.74 | NPSR1 (0.39) | NPSR1ALDH1A1MAPK1TDP1APLNR |
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-0554933-A1 | Method of preparing vicinal aminoalcohols | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1993-08-11 | — | — | EP | disclosed |