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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | BCL2 | P10415 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CDC25A | P30304 | 1/20 | 0.41 |
| ▸ | CDC25B | P30305 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MYC | P01106 | 1/20 | 0.40 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 2/20 | 0.40 |
| ▸ | RXRB | P28702 | 2/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3474963 | 0.93 | KDM4E (0.57) | KDM4EKMT2ALMNARAB9ACDC25A | |
| Isophthalic Acid SCHEMBL19579513 | 0.91 | KDM4E (0.56) | KDM4EKMT2ALMNARAB9ACDC25A | |
| SCHEMBL8650117 | 0.88 | KDM4E (0.59) | KDM4EKMT2ALMNARAB9ACDC25A | |
| SCHEMBL2174840 | 0.85 | KDM4E (0.60) | KDM4ELMNARAB9ACDC25ACDC25B | |
| SCHEMBL2933984 | 0.85 | KDM4E (0.53) | KDM4ELMNARAB9ACDC25ACDC25B | |
| Isophthalic Acid SCHEMBL11316284 | 0.83 | KDM4E (0.56) | KDM4EKMT2ACDC25ACDC25BHSD17B10 | |
| SCHEMBL27527167 | 0.81 | TSHR (0.50) | KMT2ALMNAHSD17B10AKR1C3TP53 | |
| SCHEMBL10894269 | 0.81 | MAPK1 (0.44) | KDM4EKMT2ALMNARAB9AALDH1A1 | |
| SCHEMBL4842453 | 0.80 | CDC25A (0.59) | KDM4ELMNAALDH1A1CDC25ACDC25B | |
| SCHEMBL3693858 | 0.80 | KDM4E (0.61) | KDM4ELMNARAB9AALDH1A1CDC25A |
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 |
|---|---|---|---|---|---|---|---|
| US-4147674-A | Aqueous coating composition of an acrylic-vinyl oxazoline ester polymer | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1979-04-03 | — | — | US | disclosed |