Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | PAM | P19021 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28214917 | 0.94 | DNM1 (0.50) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL6312523 | 0.94 | DNM1 (0.50) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL28069057 | 0.92 | DGKA (0.53) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL29115852 | 0.92 | DGKA (0.53) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL29115707 | 0.92 | DGKA (0.53) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL29163447 | 0.91 | ALDH1A1 (0.46) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL28657236 | 0.88 | DGKA (0.53) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL3421979 | 0.86 | CYP1A2 (0.42) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL7799203 | 0.85 | DNM1 (0.46) | CES1DNM1CES2DGKAALDH1A1 | |
| SCHEMBL22436624 | 0.84 | NAAA (0.43) | CES1DNM1CES2DGKAALDH1A1 |
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-107987196-A | For catalyst constituent for olefinic polymerization and its catalyst | 中国石油化工股份有限公司 | 2018-05-04 | — | — | CN | claimed |
| CN-107987189-A | A kind of catalyst component for olefin and its preparation method and application | 中国石油化工股份有限公司 | 2018-05-04 | — | — | CN | claimed |
| CN-107987196-A | For catalyst constituent for olefinic polymerization and its catalyst | 中国石油化工股份有限公司 | 2018-05-04 | — | — | CN | disclosed |