Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 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 | |
|---|---|---|---|---|
| SCHEMBL20495529 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| SCHEMBL25005827 | 0.80 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| SCHEMBL10599472 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| SCHEMBL28367606 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| Ammonia Solution, Strong SCHEMBL7245398 | 0.75 | HPGD (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP2D6 | |
| SCHEMBL8043146 | 0.74 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| SCHEMBL10828372 | 0.74 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| Cyanide SCHEMBL28096602 | 0.74 | MAOA (0.49) | ALDH1A1SMN1; SMN2HRH3NPC1RAB9A | |
| SCHEMBL15855667 | 0.74 | HPGD (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1 | |
| Ammonia Solution, Strong SCHEMBL7238685 | 0.74 | MAOA (0.65) | ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1 |
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-6639109-B1 | Reacting amino alcohol with sulfuric acid then reacting resulting amino sulfate with a mercaptan; simple, safe, rapid | NIHON NOHYAKU CO., LTD. (JP) | 2003-10-28 | — | — | US | disclosed |
| EP-1216988-A1 | THIOALKYLAMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF | Nihon Nohyaku Co., Ltd. (JP) | 2002-06-26 | — | — | EP | disclosed |