Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Toluic 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 | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 1/20 | 0.53 |
| ▸ | FEN1 | P39748 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | MYC | P01106 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | DHFR | P00374 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MPO | P05164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Phthalic Acid SCHEMBL5875380 | 0.88 | ALDH1A1 (0.64) | HPGDKMT2AALDH1A1KDM4EPOLB | |
| Phthalic Acid SCHEMBL4372897 | 0.88 | ALDH1A1 (0.64) | HPGDKMT2AALDH1A1KDM4EPOLB | |
| Phthalic Acid SCHEMBL7634631 | 0.86 | ALDH1A1 (0.61) | HPGDKMT2AALDH1A1KDM4EPOLB | |
| Toluic Acid SCHEMBL29281084 | 0.86 | ALDH1A1 (0.55) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL28037745 | 0.85 | ALDH1A1 (0.65) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL29414127 | 0.85 | ALDH1A1 (0.65) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL148201 | 0.85 | ALDH1A1 (0.65) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL4152 | 0.85 | ALDH1A1 (0.65) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL6571818 | 0.85 | ALDH1A1 (0.65) | ERCC5FEN1HPGDKMT2AALDH1A1 | |
| Toluic Acid SCHEMBL5748070 | 0.83 | ALDH1A1 (0.62) | ERCC5FEN1HPGDKMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109574822-A | A series of four aryl spiro-compounds and the preparation method and application thereof | 天津师范大学 | 2019-04-05 | — | — | CN | disclosed |
| US-20020077455-A1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2002-06-20 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20020077455-A1 | Protease inhibitors | CTSK, CTSZ, CTSG | ERCC5 1601/4885FEN1 1686/4885HPGD 543/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.