Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | AOC2 | O75106 | 5/20 | 0.39 |
| ▸ | MAOA | P21397 | 5/20 | 0.39 |
| ▸ | MAOB | P27338 | 5/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL10366357 | 0.86 | HTR1A (0.50) | HRH3HTR1ASIGMAR1AOC2MAOA | |
| SCHEMBL8805829 | 0.84 | HTR1A (0.53) | HTR1ASIGMAR1 | |
| SCHEMBL8805840 | 0.84 | HTR1A (0.53) | HTR1ASIGMAR1 | |
| SCHEMBL28272582 | 0.84 | TP53 (0.44) | HRH3HTR1ASIGMAR1NPC1CYP3A4 | |
| SCHEMBL10366708 | 0.84 | HRH3 (0.43) | HRH3HTR1ASIGMAR1AOC2MAOA | |
| SCHEMBL2255761 | 0.75 | HRH3 (0.49) | HRH3HTR1ASIGMAR1AOC2MAOA | |
| SCHEMBL5108298 | 0.75 | HRH3 (0.49) | HRH3HTR1ASIGMAR1AOC2MAOA | |
| SCHEMBL11535632 | 0.73 | HRH3 (0.47) | HRH3SIGMAR1AOC2MAOAMAOB | |
| SCHEMBL6723015 | 0.72 | HRH3 (0.53) | HRH3HTR1ASIGMAR1AOC2MAOA | |
| SCHEMBL718265 | 0.72 | HRH3 (0.49) | HRH3HTR1AAOC2MAOAMAOB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003080634-A1 | NOVEL GLUCOPYRANOSIDE AND A PROCESS OF ISOLATION THEREOF FROM PTEROCARPUS MARSUPIUM PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AND USE THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2003-10-02 | — | — | WO | disclosed |