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 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | BAD | Q92934 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 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 | |
|---|---|---|---|---|
| Terephthalic Acid SCHEMBL1234263 | 0.95 | TSHR (0.46) | TSHRTP53NPC1RAB9ABCL2L1 | |
| SCHEMBL8485036 | 0.93 | BCL2L1 (0.47) | TSHRTP53NPC1RAB9ABCL2L1 | |
| Terephthalic Acid SCHEMBL28622230 | 0.91 | TSHR (0.46) | TSHRTP53NPC1RAB9ABCL2L1 | |
| Terephthalic Acid SCHEMBL28279901 | 0.87 | TSHR (0.46) | TSHRTP53NPC1RAB9ABCL2L1 | |
| Terephthalic Acid SCHEMBL28482093 | 0.87 | SMN1; SMN2 (0.42) | TSHRTP53NPC1RAB9ABCL2L1 | |
| Terephthalic Acid SCHEMBL3979457 | 0.87 | TSHR (0.50) | TSHRTP53NPC1RAB9ABCL2L1 | |
| SCHEMBL5319785 | 0.85 | BCL2L1 (0.50) | TSHRTP53NPC1RAB9ABCL2L1 | |
| Tetrahydrofuran SCHEMBL9013725 | 0.85 | ALDH1A1 (0.38) | MAPTALDH1A1FAAHMGLLNCOA3 | |
| Isophthalic Acid SCHEMBL472832 | 0.84 | KMO (0.47) | NPC1RAB9AKMOALDH1A1MEN1 | |
| Terephthalic Acid SCHEMBL11133121 | 0.83 | RARB (0.48) | TP53NPC1RAB9AMAPTALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0203435-B1 | NOVEL PYRIDINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME | Chugai Seiyaku Kabushiki Kaisha (JP) | 1990-08-29 | — | — | EP | disclosed |
| US-4938683-A | Multilayer with butadiene-styrene copolymer core, a propylene polymer exterior bonded by ethylene polymer; labels for bottles | W. R. GRACE & CO.-CONN. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4879177-A | POLYESTER OR BUTADIENE-STYRENE, ETHYLENE-PROPYLENE OR POLYPROPYLENE, ETHYLENE COPOLYMER | W. R. GRACE & CO. (US) | 1989-11-07 | — | — | US | disclosed |
| US-4691018-A | Pyridine derivatives and their use as anti-allergic agents | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1987-09-01 | — | — | US | disclosed |
| EP-0203435-A2 | Novel pyridine derivatives and process for preparing the same | Chugai Seiyaku Kabushiki Kaisha (JP) | 1986-12-03 | — | — | EP | disclosed |