Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL5500281 | 0.89 | ALDH1A1 (0.44) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL20781748 | 0.83 | ALDH1A1 (0.52) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL8046984 | 0.82 | ALDH1A1 (0.57) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL5500930 | 0.79 | PTGER1 (0.43) | LMNAGAAHTR6SMN1; SMN2POLB | |
| SCHEMBL13479258 | 0.78 | ALDH1A1 (0.52) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL3154963 | 0.77 | ALDH1A1 (0.51) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL3149448 | 0.77 | ALDH1A1 (0.51) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL3149456 | 0.77 | ALDH1A1 (0.51) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL6297248 | 0.76 | ALDH1A1 (0.88) | ALDH1A1PKMLMNAGAAGLA | |
| SCHEMBL19227271 | 0.74 | ALDH1A1 (0.39) | ALDH1A1PKMLMNAGAAGLA |
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 |