Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 2,2,2-Trifluoroethanaminium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| 2,2,2-Trifluoroethanaminium SCHEMBL8247740 | 0.98 | ACE (0.58) | ACEMME | |
| Trifluoroacetamide SCHEMBL8208560 | 0.93 | ACE (0.54) | ACEMME | |
| Trifluoroacetamide SCHEMBL8247738 | 0.91 | ACE (0.56) | ACEMME | |
| SCHEMBL5565611 | 0.91 | ACE (0.62) | ACE | |
| SCHEMBL5569748 | 0.84 | ACE (0.54) | ACE | |
| SCHEMBL7044444 | 0.83 | ACE (0.53) | ACE | |
| SCHEMBL7040150 | 0.82 | ACE (0.54) | ACE | |
| SCHEMBL7042902 | 0.81 | KDM4E (0.55) | ACE | |
| 2,2,2-Trifluoroethanaminium SCHEMBL8254767 | 0.81 | GHSR (0.42) | ACEMME | |
| SCHEMBL10741668 | 0.80 | ACE (0.68) | ACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1042288-A1 | TRIPEPTIDYL PEPTIDASE INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999033801-A1 | TRIPEPTIDYL PEPTIDASE INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 1999-07-08 | — | — | WO | disclosed |