Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Trifluoromethanesulfonic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 11/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | GUSB | P08236 | 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 | |
|---|---|---|---|---|
| Silver SCHEMBL31503585 | 0.91 | TYMS (0.71) | TYMSALDH1A1CA1CA2CA9 | |
| SCHEMBL31503556 | 0.91 | TYMS (0.74) | TYMSALDH1A1CA1CA2CA9 | |
| Silver SCHEMBL31503558 | 0.90 | TYMS (0.68) | TYMSALDH1A1CA1CA2CA9 | |
| SCHEMBL9232601 | 0.70 | TYMS (0.62) | TYMSALDH1A1LMNASMN1; SMN2RAB9A | |
| SCHEMBL11884883 | 0.70 | TYMS (0.60) | TYMSALDH1A1CA1CA2CA9 | |
| SCHEMBL9229976 | 0.65 | TYMS (0.52) | TYMSALDH1A1LMNASMN1; SMN2 | |
| Tinidazole SCHEMBL27865473 | 0.63 | LMNA (0.94) | ALDH1A1CA1CA2CA9LMNA | |
| Tinidazole SCHEMBL28276477 | 0.63 | LMNA (0.72) | ALDH1A1CA1CA2CA9LMNA | |
| SCHEMBL9233969 | 0.63 | BRD2 (0.52) | TYMSALDH1A1LMNASMN1; SMN2RAB9A | |
| SCHEMBL9780864 | 0.62 | LMNA (0.64) | TYMSALDH1A1CA1CA2CA9 |
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-119859144-B | Binuclear macrocyclic metronidazole metal complex and preparation method and application thereof | 山东理工大学 | 2025-06-24 | — | — | CN | disclosed |
| CN-119859144-A | Binuclear macrocyclic metronidazole metal complex and preparation method and application thereof | 山东理工大学 | 2025-04-22 | — | — | CN | disclosed |