Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Trifluoroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ACLY | P53396 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F11 | P03951 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4069871 | 1.00 | ALDH1A1 (0.35) | ALDH1A1TSHRACLYL3MBTL1F2 | |
| Trifluoroacetic Acid SCHEMBL27831673 | 0.97 | ALDH1A1 (0.33) | ALDH1A1TSHRACLYL3MBTL1F2 | |
| Dimethyl Sulfoxide SCHEMBL28260226 | 0.81 | CA1 (0.33) | CA2 | |
| Trifluoroacetic Acid SCHEMBL28747664 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TSHRACLYL3MBTL1THRB | |
| Trifluoroacetic Acid SCHEMBL3499424 | 0.79 | — | — | |
| Trifluoroacetic Acid SCHEMBL72727 | 0.79 | — | — | |
| Trifluoroacetic Acid SCHEMBL1262416 | 0.79 | — | — | |
| Trifluoroacetic Acid SCHEMBL4598430 | 0.79 | — | — | |
| Trifluoroacetic Acid SCHEMBL7814389 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRACLYL3MBTL1THRB | |
| Trifluoroacetic Acid SCHEMBL2484766 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRACLYL3MBTL1THRB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1864129-A4 | DOXORUBICIN IMMUNOASSAY | SALADAX BIOMEDICAL INC (US) | 2009-02-18 | — | — | EP | disclosed |
| EP-1864129-A1 | DOXORUBICIN IMMUNOASSAY | Saladax Biomedical Inc. (US) | 2007-12-12 | — | — | EP | disclosed |
| WO-2006104970-A1 | DOXORUBICIN IMMUNOASSAY | SALADAX BIOMEDICAL INC. (US) | 2006-10-05 | — | — | WO | disclosed |
| EP-1689699-A2 | ANTHRANILIC ACID DERIVATIVES AND THEIR USE AS ACTIVATORS OF THE HM74A RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2006-08-16 | — | — | EP | disclosed |
| WO-2005016867-A2 | ANTHRANILIC ACID DERIVATIVES AND THEIR USE AS ACTIVATORS OF THE HM74A RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |
| EP-1326593-A1 | ESTROGEN RECEPTOR-$g(b) LIGANDS | AstraZeneca AB (SE) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002030407-A1 | ESTROGEN RECEPTOR-β LIGANDS | ASTRAZENECA AB (SE) | 2002-04-18 | — | — | WO | disclosed |