Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL9508236 | 1.00 | TAAR1 (0.47) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL9511842 | 0.93 | NPC1 (0.50) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL9508096 | 0.93 | TSHR (0.48) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL15379631 | 0.84 | TAAR1 (0.58) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL28429032 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL5831640 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL5831343 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL3794914 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL5832097 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL3800939 | 0.83 | ALDH1A1 (0.51) | TAAR1NPC1ALDH1A1TSHRSMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0322164-B1 | ETHANOLAMINE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 1993-09-22 | — | — | EP | disclosed |
| US-5039697-A | Adrenergic stimulants, bronchodilators | GLAXO GROUP LIMITED (GB) | 1991-08-13 | — | — | US | disclosed |
| US-5032609-A | Ethanolamine derivatives | GLAXO GROUP LIMITED (GB) | 1991-07-16 | — | — | US | disclosed |
| US-5002966-A | Adrenergic Stimulants | GLAXO GROUP LIMITED (GB) | 1991-03-26 | — | — | US | disclosed |
| EP-0322164-A2 | Ethanolamine derivatives | GLAXO GROUP LIMITED (GB) | 1989-06-28 | — | — | EP | disclosed |