Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6588549 | 0.88 | CYP1A2 (0.47) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL2976612 | 0.87 | GAA (0.60) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL6293793 | 0.87 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL2976618 | 0.87 | GAA (0.60) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL6597514 | 0.86 | LMNA (0.57) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL2742576 | 0.85 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL6986744 | 0.85 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL8729423 | 0.83 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL5091684 | 0.82 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2LMNAHTTGAA | |
| SCHEMBL1667910 | 0.81 | TTR (0.68) | ALDH1A1SMN1; SMN2LMNAHTTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5232978-A | 1-(2-arylethyl)-pyrrolidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-08-03 | — | — | US | disclosed |
| EP-0483580-A2 | 1-(2-Arylethyl)-pyrrolidine | MERCK PATENT GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |