Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL80793 | 0.88 | — | — | |
| SCHEMBL29723661 | 0.88 | — | — | |
| SCHEMBL27487677 | 0.86 | TRPA1 (0.39) | TRPA1ATMCYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL1317818 | 0.85 | TRPA1 (0.46) | TRPA1ATMCYP1A2CYP2A6ALDH1A1 | |
| O-Xylene SCHEMBL28370888 | 0.83 | TSHR (0.53) | TRPA1ATMCYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL11900900 | 0.76 | ATM (0.38) | TRPA1ATMCYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL15593265 | 0.74 | TRPA1 (0.41) | TRPA1ATMCYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL3838615 | 0.74 | — | — | |
| O-Xylene SCHEMBL28235475 | 0.72 | TSHR (0.67) | TRPA1CYP1A2CYP2A6ALDH1A1TSHR | |
| Malonic Acid SCHEMBL29009130 | 0.71 | PTGS2 (0.41) | TRPA1ATMCYP1A2ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1183146-A | Lithographic printing plate compositions containing acid bleachable dyes | MINNESOTA MINING & MFG (US) | 1998-05-27 | — | — | CN | claimed |
| CN-104411787-B | silicone hard coating resin composition | 韩国科学技术院 | 2017-02-22 | — | — | CN | disclosed |
| CN-1141444-A | Top coats for shoot and run printing plates | MINNESOTA MINING & MFG (US) | 1997-01-29 | — | — | CN | disclosed |