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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | CA12 | O43570 | 3/20 | 0.62 |
| ▸ | CA1 | P00915 | 3/20 | 0.62 |
| ▸ | CA2 | P00918 | 3/20 | 0.62 |
| ▸ | CA6 | P23280 | 3/20 | 0.62 |
| ▸ | CA9 | Q16790 | 3/20 | 0.62 |
| ▸ | CA4 | P22748 | 2/20 | 0.62 |
| ▸ | CA7 | P43166 | 2/20 | 0.62 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.62 |
| ▸ | CA3 | P07451 | 1/20 | 0.62 |
| ▸ | TYR | P14679 | 1/20 | 0.62 |
| ▸ | DRD1 | P21728 | 1/20 | 0.62 |
| ▸ | CA5A | P35218 | 1/20 | 0.62 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.62 |
| ▸ | CLK1 | P49759 | 1/20 | 0.58 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.58 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| Paraben SCHEMBL7261815 | 0.98 | CA12 (0.67) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL29357264 | 0.98 | MEN1 (0.66) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL44327 | 0.98 | MEN1 (0.66) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL9944055 | 0.98 | MEN1 (0.66) | MEN1NPC1RAB9AKMT2ACA12 | |
| Hydrochloric Acid SCHEMBL3923537 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 | |
| Potassium SCHEMBL7180341 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 | |
| Bicarbonate SCHEMBL9330925 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL7180331 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL5875106 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL830494 | 0.96 | MEN1 (0.63) | MEN1NPC1RAB9AKMT2ACA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1422256-B1 | THERMOTROPIC LIQUID-CRYSTAL POLYMER | UENO SEIYAKU OYO KENKYUJO KK (JP) | 2006-08-02 | — | — | EP | disclosed |
| EP-1422256-A1 | THERMOTROPIC LIQUID-CRYSTAL POLYMER | Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) | 2004-05-26 | — | — | EP | disclosed |