Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Diethylaniline SCHEMBL31469729 | 0.86 | ALDH1A1 (0.35) | TSHRALDH1A1CYP3A4CNR2MAPT | |
| Diethylaniline SCHEMBL30338071 | 0.85 | TSHR (0.48) | TSHRALDH1A1CYP3A4CNR2MAPT | |
| Benzene SCHEMBL28371694 | 0.77 | CA1 (0.31) | — | |
| Diethylaniline SCHEMBL29607002 | 0.76 | TP53 (0.32) | TP53 | |
| Diethylaniline SCHEMBL219290 | 0.76 | TP53 (0.32) | TP53 | |
| Ethylamine SCHEMBL7256955 | 0.74 | — | — | |
| Diethylaniline SCHEMBL4609227 | 0.73 | TSHR (0.59) | TSHRALDH1A1CYP3A4CNR2MAPT | |
| Diethylaniline SCHEMBL9000098 | 0.73 | TSHR (0.70) | TSHRALDH1A1CYP3A4CNR2MAPT | |
| SCHEMBL217782 | 0.73 | CA1 (0.33) | ALDH1A1LMNA | |
| Diethylaniline SCHEMBL17594 | 0.73 | TSHR (0.70) | TSHRALDH1A1CYP3A4CNR2MAPT |
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-116490528-A | Polymer compositions containing cyclics obtained using transition metal bis (phenoxide) catalyst complexes and process for their preparation | 埃克森美孚化学专利公司 | 2023-07-25 | — | — | CN | claimed |