Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | MMP14 | P50281 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NOD1 | Q9Y239 | 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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL5146818 | 0.85 | KCNH2 (0.46) | ACHEMMP2MMP9MMP13 | |
| Trifluoromethanesulfonic Acid SCHEMBL5857326 | 0.81 | CA12 (0.47) | SMN1; SMN2ALDH1A1MAPK1 | |
| Trifluoromethanesulfonic Acid SCHEMBL31221559 | 0.80 | BCHE (0.47) | KIF11FFAR4BCHEACHEPTGS2 | |
| Trifluoromethanesulfonic Acid SCHEMBL4175814 | 0.80 | MAPT (0.51) | PTGS2SMN1; SMN2TP53ALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL562050 | 0.79 | GPR3 (0.43) | FFAR4BCHEACHEMMP2MMP9 | |
| Trifluoromethanesulfonic Acid SCHEMBL5856344 | 0.78 | CA12 (0.50) | MMP2MMP14SMN1; SMN2MMP13MAPK1 | |
| Trifluoromethanesulfonic Acid SCHEMBL7911688 | 0.78 | NR3C1 (0.39) | KIF11FFAR4BCHEACHEMMP2 | |
| Trifluoromethanesulfonic Acid SCHEMBL30536270 | 0.77 | ACHE (0.43) | KIF11BCHEACHEPTGS2ALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL4182001 | 0.77 | KCNH2 (0.43) | ACHETP53ALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL4168987 | 0.77 | MMP2 (0.40) | ACHEMMP2MMP9MMP14MMP13 |
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-114591128-B | Direct cross-coupling method of aryl sulfide salt and aryl bromide | 南京工业大学 | 2023-08-22 | — | — | CN | claimed |
| CN-114591128-B | Direct cross-coupling method of aryl sulfide salt and aryl bromide | 南京工业大学 | 2023-08-22 | — | — | CN | disclosed |