Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 8/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | TP53 | P04637 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | RECQL | P46063 | 3/20 | 0.57 |
| ▸ | THPO | P40225 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | ESR1 | P03372 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.57 |
| ▸ | IGF1R | P08069 | 2/20 | 0.57 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL27820055 | 0.85 | ESR1 (0.57) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL6824102 | 0.83 | TRPA1 (0.52) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL12510871 | 0.78 | EPHX1 (0.44) | ALDH1A1ESR1CYP1A2CYP2D6SLC6A2 | |
| SCHEMBL20821109 | 0.77 | TRPA1 (0.58) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL28996201 | 0.76 | CA1 (0.61) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL6922835 | 0.74 | ALOX15 (0.50) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL19359681 | 0.73 | TRPA1 (0.59) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| Nordihydroguaiaretic Acid SCHEMBL135976 | 0.72 | ALOX15 (1.00) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| SCHEMBL57083 | 0.72 | ALOX15 (0.76) | ALOX15ALOX12KDM4EALDH1A1TP53 | |
| Nordihydroguaiaretic Acid SCHEMBL13906133 | 0.72 | ALOX15 (1.00) | ALOX15ALOX12KDM4EALDH1A1TP53 |
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-2004018416-A1 | 4-[(ALKYLSULFANYL)METHYL]-1, 2-BENZENEDIOL, PREPARATION METHOD THEREOF AND ANTIOXIDANT CONTAINING THE SAME | REX BIOSCIENCES INC. (KR) | 2004-03-04 | — | — | WO | disclosed |