Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10684907 | 0.91 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL9576103 | 0.91 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL9653991 | 0.91 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL7762345 | 0.91 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL1716623 | 0.91 | HSPA5 (0.43) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL11808205 | 0.90 | ALDH1A1 (0.47) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL11672998 | 0.88 | CYP1A2 (0.41) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL23071074 | 0.87 | TYR (0.43) | CYP2C9TP53CYP3A4BLMGMNN | |
| SCHEMBL2229760 | 0.87 | TYR (0.43) | CYP2C9TP53CYP3A4BLMGMNN | |
| SCHEMBL1274849 | 0.86 | HSPA5 (0.48) | CYP1A2CYP2C9CYP2C19ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5258433-A | FOR STABILIZING AN ORGANIC MATERIAL WHICH IS SENSITIVE TO OXIDATIVE, THERMAL AND/OR LIGHT INDUCED DEGRADATION | CIBA-GEIGY CORPORATION (US) | 1993-11-02 | — | — | US | disclosed |
| EP-0473549-A1 | Sulfoxides of alkylthiomethylphenols | CIBA-GEIGY AG (CH) | 1992-03-04 | — | — | EP | disclosed |