Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29037426 | 0.91 | TRPA1 (0.43) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL4015189 | 0.82 | ALDH1A1 (0.59) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL4617192 | 0.81 | IDO1 (0.38) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL27679103 | 0.81 | HRH3 (0.41) | TRPA1ALDH1A1TSHR | |
| SCHEMBL12336893 | 0.81 | TDP1 (0.35) | ALDH1A1TSHRTDP1 | |
| SCHEMBL3160042 | 0.78 | CA1 (0.38) | — | |
| (Phenylsulfinyl)Benzene SCHEMBL43199 | 0.78 | TDP1 (0.37) | ALDH1A1TSHRTDP1 | |
| SCHEMBL7867147 | 0.77 | CALM1 (0.57) | CES2CES1 | |
| (Phenylsulfinyl)Benzene SCHEMBL11455732 | 0.75 | TDP1 (0.35) | ALDH1A1TSHRTDP1 | |
| (Phenylsulfinyl)Benzene SCHEMBL28896702 | 0.75 | TDP1 (0.35) | ALDH1A1TSHRTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0186190-B1 | BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-05-26 | — | — | EP | disclosed |
| US-4663339-A | Acaricidal and insecticidal substituted 1-phenylalkylbenzimidazoles | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-05-05 | — | — | US | disclosed |
| EP-0186190-A2 | Benzimidazole derivatives, and their production and use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-07-02 | — | — | EP | disclosed |