Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 17/20 | 0.40 |
| ▸ | FASN | P49327 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | MELK | Q14680 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3694290 | 0.90 | HTR2A (0.40) | HTR2AFASN | |
| SCHEMBL3695386 | 0.89 | HTR2A (0.40) | HTR2AFASN | |
| SCHEMBL3705901 | 0.87 | HTR2A (0.41) | HTR2AFASN | |
| SCHEMBL13604952 | 0.87 | NPSR1 (0.43) | HTR2AFASNGSK3BDYRK1AMELK | |
| SCHEMBL3704020 | 0.86 | HTR2A (0.40) | HTR2AFASN | |
| SCHEMBL3701044 | 0.85 | HTR2A (0.42) | HTR2AFASN | |
| SCHEMBL6730692 | 0.82 | FASN (0.42) | HTR2AFASNDYRK1AMELK | |
| SCHEMBL3693110 | 0.82 | DYRK1A (0.44) | HTR2AFASNGSK3BDYRK1A | |
| SCHEMBL3692104 | 0.81 | TP53 (0.45) | HTR2AFASNDYRK1A | |
| SCHEMBL3698160 | 0.81 | HTR2A (0.41) | HTR2AFASN |
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 |
|---|---|---|---|---|---|---|---|
| EP-1851199-B1 | SUBSTITUTED BIS ARYL AND HETEROARYL COMPOUNDS AS SELECTIVE 5HT2A ANTAGONISTS | AVENTIS PHARMA INC (US) | 2012-05-16 | — | — | EP | claimed |