Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 5/20 | 0.83 |
| ▸ | CES2 | O00748 | 2/20 | 0.67 |
| ▸ | CES1 | P23141 | 2/20 | 0.67 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.62 |
| ▸ | RXRA | P19793 | 1/20 | 0.62 |
| ▸ | RXRB | P28702 | 1/20 | 0.62 |
| ▸ | RXRG | P48443 | 1/20 | 0.62 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.55 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.55 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.55 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL78879 | 0.98 | SRD5A2 (0.87) | SRD5A2CES2CES1EPHX2RXRA | |
| SCHEMBL1330891 | 0.98 | SRD5A2 (0.87) | SRD5A2CES2CES1EPHX2RXRA | |
| Hydrochloric Acid SCHEMBL8432890 | 0.95 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2RXRA | |
| Water SCHEMBL28138640 | 0.95 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2RXRA | |
| SCHEMBL1042428 | 0.95 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2RXRA | |
| SCHEMBL23521062 | 0.95 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2RXRA | |
| SCHEMBL29208531 | 0.95 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2RXRA | |
| Ethane SCHEMBL10971565 | 0.93 | SRD5A2 (0.80) | SRD5A2CES2CES1EPHX2RXRA | |
| Ethylene SCHEMBL715322 | 0.93 | SRD5A2 (0.80) | SRD5A2CES2CES1EPHX2RXRA | |
| SCHEMBL505133 | 0.91 | SRD5A2 (0.77) | SRD5A2CES2CES1EPHX2RXRA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6723483-B1 | Sulfonium salt compounds | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2004-04-20 | — | — | US | disclosed |
| EP-1238969-A2 | Sulfonium salt compounds | Wako Pure Chemical Industries, Ltd. (JP) | 2002-09-11 | — | — | EP | disclosed |
| CN-1302799-A | Sulfonium salt compound | WAKO PURE CHEM IND LTD (JP) | 2001-07-11 | — | — | CN | disclosed |
| EP-1113005-A1 | Sulfonium salt compounds | Wako Pure Chemical Industries, Ltd. (JP) | 2001-07-04 | — | — | EP | disclosed |