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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.49 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RARA | P10276 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8389006 | 0.90 | FFAR1 (0.50) | FFAR1FFAR4FAAHNFKB1NFKB2 | |
| SCHEMBL8340806 | 0.90 | FFAR1 (0.50) | FFAR1FFAR4FAAHNFKB1NFKB2 | |
| SCHEMBL8340808 | 0.90 | FFAR1 (0.50) | FFAR1FFAR4FAAHNFKB1NFKB2 | |
| SCHEMBL10382157 | 0.84 | FFAR1 (0.48) | FFAR1FFAR4FAAHNFKB1NFKB2 | |
| SCHEMBL10382159 | 0.84 | FFAR1 (0.48) | FFAR1FFAR4FAAHNFKB1NFKB2 | |
| SCHEMBL8988086 | 0.77 | FFAR4 (0.39) | FFAR1FFAR4NFKB1 | |
| SCHEMBL9161754 | 0.77 | EPHX2 (0.42) | FAAHTRPV1EPHX2ALDH1A1MAPT | |
| SCHEMBL2492444 | 0.77 | EPHX2 (0.42) | FAAHTRPV1EPHX2ALDH1A1MAPT | |
| SCHEMBL9161764 | 0.77 | EPHX2 (0.42) | FAAHTRPV1EPHX2ALDH1A1MAPT | |
| SCHEMBL9160070 | 0.77 | EPHX2 (0.42) | FAAHTRPV1EPHX2ALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0652906-B1 | METHOD OF MODIFYING POLYMERS | HENKEL KGAA (DE) | 1997-09-17 | — | — | EP | disclosed |
| US-5610242-A | REACTION WITH 2-SUBSTITUTED OXAZOLINES | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1997-03-11 | — | — | US | disclosed |
| EP-0652906-A1 | METHOD OF MODIFYING POLYMERS. | HENKEL KGAA (DE) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994003523-A1 | METHOD OF MODIFYING POLYMERS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1994-02-17 | — | — | WO | disclosed |