Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 10/20 | 0.43 |
| ▸ | ACHE | P22303 | 9/20 | 0.42 |
| ▸ | GPR3 | P46089 | 1/20 | 0.40 |
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 SCHEMBL9137907 | 0.83 | ACHE (0.43) | KCNH2ACHEGPR3 | |
| Trifluoromethanesulfonic Acid SCHEMBL29274257 | 0.81 | ACHE (0.67) | KCNH2ACHE | |
| Trifluoromethanesulfonic Acid SCHEMBL8482218 | 0.80 | ACHE (0.36) | KCNH2ACHEGPR3 | |
| SCHEMBL14999438 | 0.80 | ACHE (0.60) | ACHE | |
| Trifluoromethanesulfonic Acid SCHEMBL8332157 | 0.80 | ACHE (0.41) | KCNH2ACHEGPR3 | |
| Trifluoromethanesulfonic Acid SCHEMBL8332152 | 0.80 | ACHE (0.41) | KCNH2ACHEGPR3 | |
| Trifluoromethanesulfonic Acid SCHEMBL5705509 | 0.79 | ACHE (0.40) | KCNH2ACHEGPR3 | |
| Trifluoromethanesulfonic Acid SCHEMBL5705511 | 0.79 | ACHE (0.40) | KCNH2ACHEGPR3 | |
| Trifluoromethanesulfonic Acid SCHEMBL2996949 | 0.77 | ACHE (0.42) | KCNH2ACHE | |
| Trifluoromethanesulfonic Acid SCHEMBL664933 | 0.77 | KCNH2 (0.39) | KCNH2ACHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-111971275-A | Pyridinium, quinolinium, acridinium, pyrylium, benzopyrylium or xanthylium reactive desorption and/or laser ablation ionization matrix and use thereof | 皮尔·安德伦 | 2020-11-20 | — | — | CN | disclosed |