Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | CTSG | P08311 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| P-Xylene SCHEMBL28153320 | 1.00 | ACHE (0.67) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Cresol SCHEMBL28528164 | 0.84 | ACHE (0.77) | ACHETDP1ALDH1A1LMNACES2 | |
| Toluene SCHEMBL21051750 | 0.82 | ACHE (0.73) | ACHETDP1ALDH1A1LMNACES2 | |
| Toluene SCHEMBL22264082 | 0.82 | ACHE (0.73) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Xylene SCHEMBL11770184 | 0.82 | ACHE (1.00) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Xylene SCHEMBL460348 | 0.82 | ACHE (1.00) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Xylene SCHEMBL771 | 0.82 | — | — | |
| P-Xylene SCHEMBL11772917 | 0.82 | ACHE (1.00) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Xylene SCHEMBL28865890 | 0.78 | ACHE (0.73) | ACHETDP1ALDH1A1LMNACES2 | |
| P-Xylene SCHEMBL29262417 | 0.78 | ACHE (0.73) | ACHETDP1ALDH1A1LMNACES2 |
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-117756681-A | Preparation method of p-toluenesulfonic acid | 青岛科技大学 | 2024-03-26 | — | — | CN | disclosed |
| CN-101918367-B | Acridine compounds Facile N-alkylation in ionic liquid | 西门子医疗保健诊断公司 | 2016-08-24 | — | — | CN | disclosed |