Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5151662 | 0.90 | ALDH1A1 (0.44) | HRH3CYP3A4ALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL5155245 | 0.88 | HDAC8 (0.45) | HRH3ALDH1A1ALOX15LMNAACHE | |
| SCHEMBL7960935 | 0.84 | SLC7A5 (0.48) | ALDH1A1PTGS1TPH1SLC7A5MMP8 | |
| SCHEMBL5154261 | 0.81 | HDAC1 (0.47) | CYP3A4ALDH1A1ALOX15SMN1; SMN2HIF1A | |
| SCHEMBL5151172 | 0.81 | TPH1 (0.39) | ALDH1A1LMNAPTGS1OPRM1TPH1 | |
| SCHEMBL14139328 | 0.80 | SLC7A5 (0.44) | CYP3A4ALDH1A1LMNAPTGS1TDP1 | |
| SCHEMBL21117856 | 0.80 | SLC7A5 (0.44) | ALDH1A1SMN1; SMN2MAPTLMNAPTGS1 | |
| SCHEMBL20543461 | 0.80 | SLC7A5 (0.44) | ALDH1A1SMN1; SMN2MAPTLMNAPTGS1 | |
| SCHEMBL9967935 | 0.80 | SLC7A5 (0.44) | ALDH1A1SMN1; SMN2MAPTLMNAPTGS1 | |
| Hydrochloric Acid SCHEMBL20543828 | 0.79 | ACACB (0.43) | ALDH1A1PTGS1MEN1KMT2ATPH1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7157454-B2 | Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same | SANOFI-AVENTIS (FR) | 2007-01-02 | — | — | US | disclosed |
| US-20040116353-A1 | Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same | SANOFI (FR) | 2004-06-17 | — | — | US | disclosed |