Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9518280 | 0.98 | AOC3 (0.40) | AOC3TAAR1PYCR1IDO1SLC6A4 | |
| SCHEMBL9737481 | 0.85 | AOC3 (0.45) | AOC3TAAR1PYCR1IDO1SLC6A4 | |
| Hydrochloric Acid SCHEMBL9518394 | 0.83 | AOC3 (0.44) | AOC3TAAR1PYCR1IDO1SLC6A4 | |
| SCHEMBL9879437 | 0.80 | SLC6A2 (0.47) | AOC3TAAR1SLC6A4SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL9518503 | 0.78 | SLC6A2 (0.46) | AOC3IDO1SLC6A4AGXTSLC6A2 | |
| SCHEMBL9737153 | 0.77 | GBA1 (0.41) | AOC3TAAR1PYCR1HTTLMNA | |
| SCHEMBL9735994 | 0.77 | CNR2 (0.48) | AOC3PYCR1ALDH1A1HTTRAB9A | |
| SCHEMBL934572 | 0.77 | BCL2A1 (0.51) | AOC3TAAR1RAB9APOLB | |
| SCHEMBL28980138 | 0.76 | AOC3 (0.47) | AOC3SLC6A4SLC6A2SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9457770 | 0.76 | BCL2A1 (0.50) | AOC3IDO1AGXTRAB9APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5081145-A | Contractile prostaglandin antagonists | MERCK FROSST CANADA, INC. (CA) | 1992-01-14 | — | — | US | disclosed |