Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21654483 | 0.83 | CYP1A2 (0.37) | CYP1A2MEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL9908326 | 0.83 | CYP1A2 (0.37) | CYP1A2MEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL9972960 | 0.81 | CHRM2 (0.35) | NR1H2CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL22902344 | 0.80 | — | — | |
| SCHEMBL16137372 | 0.77 | EPHX2 (0.40) | NR1H2CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL19889369 | 0.77 | CYP3A4 (0.31) | CYP1A2CYP3A4CYP2D6TSHRMAPK1 | |
| SCHEMBL13596410 | 0.77 | CHRNB2 (0.34) | CYP1A2ALDH1A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL22311529 | 0.76 | — | — | |
| SCHEMBL12271054 | 0.76 | CYP1A2 (0.33) | CYP1A2CYP2C19CYP3A4CYP2D6TSHR | |
| SCHEMBL13596409 | 0.76 | CHRNB2 (0.33) | CYP1A2CYP3A4CYP2D6TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3744790-B1 | MOLDED ARTICLE | MITSUBISHI GAS CHEMICAL CO (JP) | 2021-07-21 | — | — | EP | disclosed |
| EP-3744790-A1 | MOLDED ARTICLE | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2020-12-02 | — | — | EP | disclosed |