Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15172767 | 0.83 | ALDH1A1 (0.48) | TRPA1ALDH1A1TSHRCASP1KDM4E | |
| SCHEMBL1679453 | 0.81 | TP53 (0.40) | TRPA1ALDH1A1TP53TDP1TSHR | |
| SCHEMBL2659542 | 0.79 | TRPA1 (0.44) | TRPA1ALDH1A1TP53TDP1TSHR | |
| SCHEMBL27462523 | 0.79 | TRPA1 (0.44) | TRPA1ALDH1A1TP53TDP1TSHR | |
| SCHEMBL12463870 | 0.79 | ALDH1A1 (0.43) | TRPA1ALDH1A1TSHRKDM4ECYP1A2 | |
| SCHEMBL31507723 | 0.75 | ALDH1A1 (0.40) | TRPA1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL14784427 | 0.75 | PDE10A (0.48) | ALDH1A1TP53TDP1TSHRCASP1 | |
| SCHEMBL5747054 | 0.75 | ALDH1A1 (0.40) | TRPA1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL13127020 | 0.75 | CYP3A4 (0.37) | TRPA1ALDH1A1TP53TDP1TSHR | |
| SCHEMBL27375821 | 0.75 | ALDH1A1 (0.40) | TRPA1ALDH1A1KDM4ECYP3A4HPGD |
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-105722830-B | Aryl thioethers derivative and aryl sulfoxid es derivative as acaricide and insecticide | 拜耳作物科学股份公司 | 2019-06-04 | — | — | CN | disclosed |
| CN-105473558-B | Aromatic yl sulfide derivative and aryl oxysulfide derivative as acaricide and insecticide | 拜耳作物科学股份公司 | 2019-04-19 | — | — | CN | disclosed |
| US-9212385-B2 | Fluorinated resorufin compounds and their application | Life Technologies Corporation (US) | 2015-12-15 | — | — | US | disclosed |