Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Terephthalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TPMT | P51580 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL934175 | 0.90 | PYGM (0.32) | ALDH1A1 | |
| SCHEMBL29101400 | 0.80 | TP53 (0.30) | TSHRTP53 | |
| SCHEMBL818160 | 0.79 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL5709301 | 0.77 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL5709302 | 0.77 | ALDH1A1 (0.35) | ALDH1A1 | |
| Terephthalic Acid SCHEMBL5054081 | 0.72 | TSHR (0.75) | TSHRTP53SRD5A2CA1CA12 | |
| SCHEMBL7184654 | 0.70 | PYGM (0.32) | ALDH1A1 | |
| SCHEMBL28393336 | 0.70 | ALDH1A1 (0.30) | CA1CA9ALDH1A1 | |
| Terephthalic Acid SCHEMBL28261396 | 0.70 | TSHR (0.80) | TSHRTP53SRD5A2CA1CA12 | |
| Terephthalic Acid SCHEMBL448283 | 0.70 | TSHR (0.80) | TSHRTP53SRD5A2CA1CA12 |
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-117003636-A | Phthalic acid compound and application thereof | 四川省中医药科学院 | 2023-11-07 | — | — | CN | disclosed |