Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11336523 | 0.81 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL4070869 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTPOLBMEN1KMT2A | |
| SCHEMBL4556950 | 0.78 | — | — | |
| SCHEMBL8595989 | 0.76 | — | — | |
| SCHEMBL14942867 | 0.75 | MAPT (0.39) | ALDH1A1MAPTSLC6A2SLC6A4MEN1 | |
| SCHEMBL3196567 | 0.75 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9ASLC6A2SLC6A4 | |
| SCHEMBL24096428 | 0.74 | — | — | |
| SCHEMBL229577 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL11307439 | 0.74 | ALDH1A1 (0.40) | ALDH1A1MAPT | |
| SCHEMBL25180359 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0654025-A4 | METHOD OF PREPARING OPTICALLY PURE PRECURSORS OF PAROXETINE. | SEPRACOR INC (US) | 1995-10-11 | — | — | EP | disclosed |
| EP-0654025-A1 | METHOD OF PREPARING OPTICALLY PURE PRECURSORS OF PAROXETINE | SEPRACOR, INC. (US) | 1995-05-24 | — | — | EP | disclosed |
| WO-1994003428-A1 | METHOD OF PREPARING OPTICALLY PURE PRECURSORS OF PAROXETINE | SEPRACOR, INC. (US) | 1994-02-17 | — | — | WO | disclosed |
| US-5258517-A | Method of preparing optically pure precursors of paroxetine | SEPRACOR, INC. (US) | 1993-11-02 | — | — | US | disclosed |