Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 17/20 | 0.63 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27809190 | 0.82 | AOC3 (0.67) | AOC3RORCENPP2KDM4EALDH1A1 | |
| SCHEMBL27809187 | 0.79 | AOC3 (0.67) | AOC3RORCKDM4EALDH1A1GAA | |
| SCHEMBL1432665 | 0.79 | AOC3 (0.68) | AOC3ENPP2KDM4EALDH1A1GAA | |
| SCHEMBL1432878 | 0.79 | AOC3 (0.74) | AOC3RORCKDM4EALDH1A1GAA | |
| SCHEMBL1432620 | 0.78 | AOC3 (0.73) | AOC3RORCENPP2KDM4EALDH1A1 | |
| SCHEMBL1432804 | 0.78 | AOC3 (0.76) | AOC3RORCKDM4EALDH1A1GAA | |
| SCHEMBL1432309 | 0.78 | AOC3 (1.00) | AOC3 | |
| SCHEMBL27809188 | 0.77 | AOC3 (0.82) | AOC3KDM4EALDH1A1GAAMAPT | |
| SCHEMBL4467602 | 0.77 | AOC3 (0.79) | AOC3RORCKDM4EALDH1A1GAA | |
| SCHEMBL16606221 | 0.77 | AOC3 (0.78) | AOC3RORCKDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102046601-B | Benzene or thiophene derivative and use thereof as VAP-1 inhibitor | R TECH UENO LTD | 2014-08-27 | — | — | CN | disclosed |
| CN-102046601-A | Benzene or thiophene derivative and use thereof as VAP-1 inhibitor | R TECH UENO LTD | 2011-05-04 | — | — | CN | disclosed |