Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Isophthalic 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 | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.60 |
| ▸ | CA12 | O43570 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | CA6 | P23280 | 1/20 | 0.60 |
| ▸ | CA9 | Q16790 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | DAO | P14920 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Isophthalic Acid SCHEMBL259039 | 0.95 | KMO (0.60) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL27962393 | 0.95 | KMO (0.60) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL28737082 | 0.93 | KMO (0.58) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL10696844 | 0.92 | CA12 (0.68) | KMOCA12CA1CA2CA6 | |
| Terephthalic Acid SCHEMBL21273913 | 0.91 | TSHR (0.56) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL6280488 | 0.90 | CA12 (0.65) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL20500514 | 0.89 | CA12 (0.71) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL22462 | 0.89 | CA12 (0.71) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL147366 | 0.89 | CA12 (0.71) | KMOCA12CA1CA2CA6 | |
| Isophthalic Acid SCHEMBL2512374 | 0.89 | CA12 (0.71) | KMOCA12CA1CA2CA6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1035194-B1 | Use of comb polymers as soil release polymers | CLARIANT GMBH (DE) | 2004-09-15 | — | — | EP | claimed |
| EP-1035194-A2 | Use of comb polymers as soil release polymers | Clariant GmbH (DE) | 2000-09-13 | — | — | EP | claimed |