Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | RYR2 | Q92736 | 10/20 | 0.43 |
| ▸ | STS | P08842 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28455483 | 0.90 | ESR2 (0.51) | ESR2NR1H2MEN1KMT2AMAPK1 | |
| SCHEMBL30015973 | 0.85 | ESR2 (0.51) | ESR2NR1H2MAPK1HDAC1RYR2 | |
| SCHEMBL26654042 | 0.85 | ESR2 (0.51) | ESR2NR1H2MAPK1HDAC1RYR2 | |
| SCHEMBL30657943 | 0.82 | KDM4E (0.49) | ESR2NR1H2MAPK1HDAC1RYR2 | |
| SCHEMBL26653897 | 0.82 | KDM4E (0.49) | ESR2NR1H2MAPK1HDAC1RYR2 | |
| SCHEMBL5848351 | 0.82 | RYR2 (0.62) | ESR2NR1H2MAPK1RYR2 | |
| SCHEMBL807127 | 0.81 | ESR2 (0.65) | ESR2NR1H2MAPK1RYR2 | |
| SCHEMBL19684692 | 0.80 | ESR2 (0.78) | ESR2NR1H2MEN1KMT2AMAPK1 | |
| SCHEMBL29388008 | 0.80 | NR1H2 (0.72) | ESR2NR1H2MEN1KMT2AMAPK1 | |
| SCHEMBL31621670 | 0.80 | ESR2 (0.78) | ESR2NR1H2MEN1KMT2AMAPK1 |
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-111518055-A | Preparation method of benzothiazepine oxide, product prepared by preparation method and application of product | 西安都创医药科技有限公司 | 2020-08-11 | — | — | CN | claimed |
| CN-111518055-A | Preparation method of benzothiazepine oxide, product prepared by preparation method and application of product | 西安都创医药科技有限公司 | 2020-08-11 | — | — | CN | disclosed |