Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.34 |
| ▸ | HTR2C | P28335 | 6/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9300289 | 1.00 | HTR2A (0.34) | HTR2AHTR2CSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9450894 | 0.88 | SLC6A2 (0.32) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8962798 | 0.85 | CNR1 (0.36) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL8962799 | 0.85 | CNR1 (0.36) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL8963047 | 0.83 | KCNH2 (0.33) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL8963053 | 0.83 | KCNH2 (0.33) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL8963262 | 0.82 | EP300 (0.32) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL8963255 | 0.82 | EP300 (0.32) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL21113145 | 0.81 | HTR2A (0.39) | HTR2AHTR2CSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8963292 | 0.80 | PROKR1 (0.33) | HTR2AHTR2CMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |