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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.74 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.74 |
| ▸ | TSHR | P16473 | 3/20 | 0.65 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.65 |
| ▸ | DAO | P14920 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.62 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.61 |
| ▸ | CES2 | O00748 | 1/20 | 0.61 |
| ▸ | CES1 | P23141 | 1/20 | 0.61 |
| ▸ | CDC25B | P30305 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | CDC25A | P30304 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Terephthalic Acid SCHEMBL108623 | 0.97 | ALDH1A1 (0.78) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL322997 | 0.92 | TSHR (0.78) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL30665138 | 0.92 | TSHR (0.78) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL4578569 | 0.92 | TSHR (0.78) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Terephthalic Acid SCHEMBL10802150 | 0.90 | CDC25B (0.73) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL28331573 | 0.90 | TSHR (0.74) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL5078834 | 0.90 | TSHR (0.74) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL29055925 | 0.90 | TSHR (0.74) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL382866 | 0.89 | ALDH1A1 (0.93) | ALDH1A1ALOX15TSHRNAPRTDAO | |
| Phthalic Acid SCHEMBL5036784 | 0.89 | ALDH1A1 (0.93) | ALDH1A1ALOX15TSHRNAPRTDAO |
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 |
|---|---|---|---|---|---|---|---|
| EP-0787747-B1 | PROCES FOR THE PREPARATION OF SOLID CATALYTIC COMPONENTS AND OF A CATALYST FOR POLYMERIZING OLEFINS | TOHO TITANIUM CO LTD (JP) | 2001-11-21 | — | — | EP | disclosed |