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 | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3298195 | 0.97 | MAPK1 (0.47) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| Isophthalic Acid SCHEMBL10993292 | 0.94 | MAPK1 (0.46) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| Ethylene Glycol SCHEMBL8373776 | 0.94 | MAPK1 (0.45) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| SCHEMBL10348750 | 0.91 | MAPK1 (0.51) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| SCHEMBL21143384 | 0.91 | SERPINE1 (0.51) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| SCHEMBL3453488 | 0.88 | MAPT (0.49) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| Ethylene Glycol SCHEMBL11412767 | 0.85 | MAPT (0.46) | MAPK1HIF1ASERPINE1TDP1HTR1A | |
| Terephthalic Acid SCHEMBL6690767 | 0.85 | RXRA (0.47) | KMT2ACYP2C9NR1H4RXRARXRB | |
| SCHEMBL11048926 | 0.84 | LTB4R (0.40) | MAPK1HIF1ATDP1NPC1 | |
| SCHEMBL11042836 | 0.84 | LTB4R (0.40) | MAPK1HIF1ATDP1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004069896-A1 | PROCESS FOR PRODUCING NEOPENTYL-GLYCOL BASED POLYESTERS | SURFACE SPECIALTIES, S.A. (BE) | 2004-08-19 | — | — | WO | disclosed |