Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NAAA | Q02083 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 5/20 | 0.40 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.40 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.38 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21114421 | 0.85 | TSHR (1.00) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| SCHEMBL1820543 | 0.85 | TSHR (1.00) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| SCHEMBL196731 | 0.85 | TSHR (1.00) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| SCHEMBL6061809 | 0.85 | TSHR (1.00) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| SCHEMBL28140301 | 0.81 | TSHR (0.68) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| Acetic Acid SCHEMBL7763816 | 0.80 | TSHR (0.79) | TSHRLMNATRPA1ALDH1A1SMN1; SMN2 | |
| Dimethylketone Cyanohydrin SCHEMBL6357582 | 0.77 | TSHR (0.73) | TSHRLMNATRPA1ALDH1A1KDM4E | |
| SCHEMBL6056000 | 0.76 | TSHR (0.79) | TSHRLMNATRPA1ALDH1A1SMN1; SMN2 | |
| Benzoic Acid SCHEMBL16058242 | 0.74 | TSHR (0.76) | TSHRLMNATRPA1ALDH1A1POLB | |
| SCHEMBL2686608 | 0.74 | ALDH1A1 (0.49) | TSHRLMNANAAAALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-115785000-A | 2- (phenoxy or phenylthio) pyrimidine derivatives as herbicides, compositions thereof and methods of controlling undesirable vegetation therewith | FMC公司 | 2023-03-14 | — | — | CN | disclosed |
| CN-107635974-B | 2- (phenoxy or phenylthio) pyrimidine derivatives as herbicides | FMC公司 | 2022-12-20 | — | — | CN | disclosed |