Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5234435 | 0.94 | HRH3 (0.45) | ALDH1A1ACHEKDM4EHRH3RAB9A | |
| SCHEMBL5236489 | 0.81 | ACACB (0.49) | ALDH1A1KDM4EHRH3 | |
| Hydrochloric Acid SCHEMBL5151770 | 0.80 | ACACB (0.48) | ALDH1A1KDM4EHRH3 | |
| Trifluoroacetic Acid SCHEMBL5151636 | 0.77 | HRH3 (0.44) | DPP4HRH3DPP8DPP7 | |
| Trifluoroacetic Acid SCHEMBL5150811 | 0.76 | GRB2 (0.44) | KCNH2ALDH1A1ACHEKDM4EDPP4 | |
| SCHEMBL5150891 | 0.76 | ACE (0.44) | ACHEHRH3KMT2A | |
| Trifluoroacetic Acid SCHEMBL5155526 | 0.74 | GRB2 (0.42) | DPP4HRH3SLC2A1OPRD1 | |
| Trifluoroacetic Acid SCHEMBL5151176 | 0.74 | GRB2 (0.42) | KCNH2ALDH1A1ACHEKDM4EDPP4 | |
| SCHEMBL27537681 | 0.73 | CHRM2 (0.41) | KCNH2ALDH1A1ACHEKDM4EDPP4 | |
| Trifluoroacetic Acid SCHEMBL5151174 | 0.72 | GRB2 (0.40) | OPRD1 |
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 |