Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.39 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.39 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.37 |
| ▸ | FLT4 | P35916 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22269170 | 0.86 | TSHR (0.43) | TSHRTDP1CYP1A2ALDH1A1GAA | |
| SCHEMBL29078865 | 0.72 | TSHR (0.50) | TSHRTDP1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL1759743 | 0.71 | TSHR (0.73) | TSHRTDP1ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL9412338 | 0.70 | ALDH1A1 (0.56) | TSHRTDP1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL250144 | 0.70 | ALDH1A1 (0.80) | TDP1ALDH1A1CYP3A4MAPK1MEN1 | |
| SCHEMBL19141251 | 0.70 | TSHR (0.48) | TSHRTDP1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL10340780 | 0.70 | TSHR (0.48) | TSHRTDP1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL19141768 | 0.70 | PTGS2 (0.48) | TSHRTDP1CYP1A2ALDH1A1CYP3A4 | |
| Chlorobenzene SCHEMBL9364353 | 0.68 | TSHR (0.68) | TSHRTDP1ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL4300190 | 0.68 | ALDH1A1 (0.59) | TSHRALDH1A1CYP3A4MAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117447370-A | Preparation method of aggregation-induced emission material tetraaryl divinyl sulfide | 山西蓬勃健康科技有限公司 | 2024-01-26 | — | — | CN | disclosed |