Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 5/20 | 0.46 |
| ▸ | MAN2A1 | Q16706 | 2/20 | 0.41 |
| ▸ | MAN1B1 | Q9UKM7 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | RGS12 | O14924 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9728971 | 0.80 | AOC3 (0.52) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9729326 | 0.78 | AOC3 (0.57) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9729227 | 0.76 | AOC3 (0.55) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9729467 | 0.75 | AOC3 (0.53) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL29433956 | 0.75 | AOC3 (0.53) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9728901 | 0.73 | ALDH1A1 (0.54) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9729228 | 0.72 | AOC3 (0.50) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL10523671 | 0.71 | AOC3 (0.49) | AOC3MAN2A1MAN1B1CYP3A4CYP2D6 | |
| SCHEMBL9729722 | 0.71 | AOC3 (0.49) | AOC3MAN2A1MAN1B1SLC6A2SLC6A4 | |
| SCHEMBL9729174 | 0.71 | AOC3 (0.49) | AOC3MAN2A1MAN1B1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5171753-A | Derivatives of 2-amino-1-phenylethanol having antiulcer activity | A. H. ROBINS COMPANY, INCORPORATED (US) | 1992-12-15 | — | — | US | disclosed |