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 | 5/20 | 0.77 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.77 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.68 |
| ▸ | ACHE | P22303 | 1/20 | 0.59 |
| ▸ | RXRA | P19793 | 1/20 | 0.55 |
| ▸ | RXRB | P28702 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | CES2 | O00748 | 2/20 | 0.52 |
| ▸ | CES1 | P23141 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | TPMT | P51580 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Aminobenzoic Acid SCHEMBL8775569 | 1.00 | ALDH1A1 (0.77) | ALDH1A1SMN1; SMN2SRD5A2ACHERXRA | |
| Aminobenzoic Acid SCHEMBL9985557 | 0.91 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2SRD5A2ACHERXRA | |
| Aminobenzoic Acid SCHEMBL5874326 | 0.88 | TSHR (0.63) | ALDH1A1SMN1; SMN2SRD5A2RXRARXRB | |
| 4-Methylbenzoic Acid SCHEMBL28343792 | 0.88 | ALDH1A1 (0.90) | ALDH1A1SMN1; SMN2SRD5A2RXRARXRB | |
| 4-Methylbenzoic Acid SCHEMBL1667362 | 0.88 | ALDH1A1 (0.90) | ALDH1A1SMN1; SMN2SRD5A2RXRARXRB | |
| Aminobenzoic Acid SCHEMBL11323913 | 0.88 | TSHR (0.63) | ALDH1A1SMN1; SMN2SRD5A2RXRARXRB | |
| Aminobenzoic Acid SCHEMBL1768920 | 0.88 | TSHR (0.71) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| Terephthalic Acid SCHEMBL7648718 | 0.88 | TSHR (0.71) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| Terephthalic Acid SCHEMBL9717815 | 0.88 | TSHR (0.71) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| Aminobenzoic Acid SCHEMBL8249 | 0.88 | TSHR (0.71) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113600112-A | Preparation method and device of 2, 5-di (p-toluidine) terephthalic acid | 彩客化学(沧州)有限公司 | 2021-11-05 | — | — | CN | claimed |
| CN-1144845-C | Contineous preparing method for quinacridineone | — | 2004-04-07 | — | — | CN | claimed |
| CN-1280150-A | Contineous preparing method for quinacridineone | BAYER AG (US) | 2001-01-17 | — | — | CN | claimed |
| CN-113600112-B | Device for preparing 2,5-di (p-toluidinyl) terephthalic acid | 河北彩客新材料科技股份有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-113600112-B | Device for preparing 2,5-di (p-toluidinyl) terephthalic acid | 河北彩客新材料科技股份有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-113600112-A | Preparation method and device of 2, 5-di (p-toluidine) terephthalic acid | 彩客化学(沧州)有限公司 | 2021-11-05 | — | — | CN | disclosed |
| CN-113600112-A | Preparation method and device of 2, 5-di (p-toluidine) terephthalic acid | 彩客化学(沧州)有限公司 | 2021-11-05 | — | — | CN | disclosed |
| CN-113600112-A | Preparation method and device of 2, 5-di (p-toluidine) terephthalic acid | 彩客化学(沧州)有限公司 | 2021-11-05 | — | — | CN | disclosed |
| CN-112812615-A | Preparation method of graphene-containing easily-dispersible pigment | 宇虹颜料股份有限公司 | 2021-05-18 | — | — | CN | disclosed |
| CN-1144845-C | Contineous preparing method for quinacridineone | — | 2004-04-07 | — | — | CN | disclosed |
| CN-1280150-A | Contineous preparing method for quinacridineone | BAYER AG (US) | 2001-01-17 | — | — | CN | disclosed |