Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | SHBG | P04278 | 1/20 | 0.45 |
| ▸ | MDH1 | P40925 | 10/20 | 0.37 |
| ▸ | MDH2 | P40926 | 10/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | APAF1 | O14727 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | FYN | P06241 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29167511 | 0.85 | CYP3A4 (0.44) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL10779755 | 0.83 | FFAR1 (0.34) | CYP3A4SMN1; SMN2MEN1ALDH1A1LMNA | |
| SCHEMBL24564756 | 0.80 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL7059497 | 0.80 | CYP3A4 (0.47) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL15135854 | 0.78 | CYP3A4 (0.57) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL4619376 | 0.74 | CYP3A4 (0.56) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL28687387 | 0.74 | PPARA (0.39) | CYP3A4TSHRSLC6A2HTR2ASLC6A4 | |
| SCHEMBL10387361 | 0.74 | CYP3A4 (0.46) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL29238194 | 0.74 | CYP3A4 (0.42) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| Hydrochloric Acid SCHEMBL8695973 | 0.74 | MEN1 (0.57) | CYP3A4SMN1; SMN2SHBGHIF1AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117645531-A | Preparation method of p-tert-octyl phenoxy ethoxy ethyl chloride | 扬州市普林斯医药科技有限公司 | 2024-03-05 | — | — | CN | disclosed |
| CN-117645531-A | Preparation method of p-tert-octyl phenoxy ethoxy ethyl chloride | 扬州市普林斯医药科技有限公司 | 2024-03-05 | — | — | CN | disclosed |