Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CD44 | P16070 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11192672 | 0.85 | TRPA1 (0.42) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL11181553 | 0.83 | TRPA1 (0.41) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL585558 | 0.79 | TRPA1 (0.46) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL4455357 | 0.79 | ACHE (0.47) | TSHRALDH1A1CYP1A2CYP2A6LMNA | |
| SCHEMBL11197299 | 0.78 | ALDH1A1 (0.37) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL5436537 | 0.77 | TRPA1 (0.44) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL30733276 | 0.77 | MAPT (0.48) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL1911943 | 0.77 | MAPT (0.48) | TRPA1ATMMAPTTSHRALDH1A1 | |
| SCHEMBL10796509 | 0.76 | ALDH1A1 (0.36) | TRPA1ATMTSHRALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2861142 | 0.75 | MAPT (0.46) | TRPA1ATMMAPTTSHRALDH1A1 |
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-5068435-A | Alkylation of amines with alkenes in the presence of alumina catalyst | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0334332-A1 | Ortho-alkylated aromatic amines via gamma alumina catalyst | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-09-27 | — | — | EP | disclosed |