Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Trichloroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trichloroacetic Acid SCHEMBL108356 | 1.00 | — | — | |
| Trichloroacetic Acid SCHEMBL19810503 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL60578 | 0.92 | — | — | |
| Trichloroacetic Acid SCHEMBL6916725 | 0.92 | TSHR (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL18685945 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL1178275 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL7211445 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL465138 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 | |
| Trichloroacetic Acid SCHEMBL7787579 | 0.92 | — | — | |
| Trichloroacetic Acid SCHEMBL11108028 | 0.92 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRCA4CA1 |
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-111417620-B | Creatine prodrugs, compositions thereof, and methods of use | 奥特吉尼克斯制药公司 | 2023-08-25 | — | — | CN | disclosed |
| CN-111417620-A | Creatine prodrugs, compositions thereof, and methods of use | 奥特吉尼克斯制药公司 | 2020-07-14 | — | — | CN | disclosed |