Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 11/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5495247 | 0.89 | ALDH1A1 (0.51) | ALDH1A1PKMLMNAGAAHTR6 | |
| SCHEMBL20781748 | 0.79 | ALDH1A1 (0.52) | ALDH1A1PKMLMNAGAAPRMT5 | |
| SCHEMBL3154839 | 0.79 | PKM (0.44) | ALDH1A1PKMLMNAGAAHTR6 | |
| SCHEMBL3144829 | 0.79 | PKM (0.44) | ALDH1A1PKMLMNAGAAHTR6 | |
| SCHEMBL3144836 | 0.79 | PKM (0.44) | ALDH1A1PKMLMNAGAAHTR6 | |
| SCHEMBL5501492 | 0.73 | POLB (0.56) | GAAHTR6HTR2AHTR2CHTR2B | |
| SCHEMBL19227271 | 0.71 | ALDH1A1 (0.39) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL8046984 | 0.71 | ALDH1A1 (0.57) | ALDH1A1PKMLMNAGAAHTR6 | |
| SCHEMBL9635801 | 0.70 | PKM (0.59) | ALDH1A1PKMLMNAGAAPRMT5 | |
| SCHEMBL9065839 | 0.70 | ALDH1A1 (0.70) | ALDH1A1PKMLMNAGAAHTR6 |
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-1748995-A1 | ARYLSULFONYL BENZODIOXANES USEFUL FOR MODULATION THE 5-HT6 RECEPTOR, THE 5-HT2ARECEPTOR OR BOTH | F. Hoffmann-La Roche AG (CH) | 2007-02-07 | — | — | EP | disclosed |
| WO-2005105776-A1 | ARYLSULFONYL BENZODIOXANES USEFUL FOR MODULATION THE 5-HT6 RECEPTOR, THE 5-HT2ARECEPTOR OR BOTH | F. HOFFMANN-LA ROCHE AG (CH) | 2005-11-10 | — | — | WO | disclosed |