Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HRH1 | P35367 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18471695 | 0.89 | AOC3 (0.58) | AOC3HTR2AHRH1TAAR1SIGMAR1 | |
| SCHEMBL8084153 | 0.83 | SIGMAR1 (0.59) | AOC3SIGMAR1KCNH2 | |
| SCHEMBL8096616 | 0.81 | AOC3 (0.58) | AOC3HTR2AHRH1TAAR1TDP1 | |
| SCHEMBL8100041 | 0.81 | SIGMAR1 (0.62) | AOC3SIGMAR1KCNH2 | |
| SCHEMBL25953921 | 0.81 | AOC3 (0.62) | AOC3HTR2AHRH1TAAR1TDP1 | |
| SCHEMBL8091657 | 0.80 | SIGMAR1 (0.65) | AOC3SIGMAR1KCNH2 | |
| SCHEMBL14820159 | 0.80 | AOC3 (0.61) | AOC3HTR2AHRH1TAAR1TDP1 | |
| SCHEMBL8099621 | 0.80 | SIGMAR1 (0.51) | AOC3SIGMAR1KCNH2 | |
| SCHEMBL8084280 | 0.79 | SIGMAR1 (0.57) | AOC3TAAR1SIGMAR1 | |
| SCHEMBL13974808 | 0.77 | PIK3CD (0.53) | AOC3HTR2AHRH1TAAR1SIGMAR1 |
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-20010047097-A1 | Process for the preparation of arylethylamines by amination of arylolefins | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) | 2001-11-29 | — | — | US | disclosed |
| EP-1157983-A1 | Process for the preparation of arylethylamines via the amination of arylolefins | Aventis Research & Technologies GmbH & Co KG (DE) | 2001-11-28 | — | — | EP | disclosed |