Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | APAF1 | O14727 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | FYN | P06241 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14685191 | 0.88 | CYP3A4 (0.64) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL9632640 | 0.85 | CYP3A4 (0.60) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL29167471 | 0.85 | CYP3A4 (0.60) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL7118081 | 0.84 | HTT (0.49) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL10604595 | 0.83 | SMN1; SMN2 (0.41) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL8679414 | 0.82 | CYP3A4 (0.57) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL27231886 | 0.82 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL4614655 | 0.82 | TDP1 (0.44) | MEN1KMT2ALMNAMAPTTDP1 | |
| Hydrochloric Acid SCHEMBL26134088 | 0.81 | SMN1; SMN2 (0.56) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A | |
| SCHEMBL7879426 | 0.80 | CYP3A4 (0.61) | SMN1; SMN2CYP3A4HIF1AMEN1KMT2A |
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 3 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-106242974-B | The method of extraction ethyl vanillate and application in a kind of peony | 重庆工商大学 | 2018-08-17 | — | — | CN | disclosed |
| CN-106242974-A | A kind of Flos Moutan is extracted method and the application of ethyl vanillate | 重庆工商大学 | 2016-12-21 | — | — | CN | disclosed |