Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL10969010 | 0.81 | TSHR (0.43) | ALDH1A1MAPTCA1CA2CA7 | |
| SCHEMBL15694588 | 0.77 | TRPA1 (0.44) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL160022 | 0.77 | ESR1 (0.49) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL6830746 | 0.77 | TRPA1 (0.44) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL8445208 | 0.77 | TRPA1 (0.44) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL30933674 | 0.77 | ESR1 (0.49) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL6761818 | 0.77 | MAPT (0.53) | TRPA1ATMALDH1A1MAPTESR1 | |
| Hydrochloric Acid SCHEMBL3656251 | 0.76 | ESR1 (0.47) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL6515010 | 0.75 | TRPA1 (0.52) | TRPA1ATMALDH1A1MAPTESR1 | |
| SCHEMBL102966 | 0.74 | LMNA (0.43) | TRPA1ATMALDH1A1MAPTESR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2009102243-A | ACTIVE OXYGEN SCAVENGER IN LIVING CELL CHARACTERIZED BY CONTAINING SELENOAMIDE AND ITS USE | GUNMA PREFECTURE | 2009-05-14 | — | — | JP | disclosed |