Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL384159 | 0.92 | ESR1 (0.40) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL29407805 | 0.88 | ESR1 (0.43) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL812773 | 0.88 | ESR1 (0.43) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL29112874 | 0.83 | ESR1 (0.35) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL382295 | 0.81 | ESR1 (0.43) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL29445690 | 0.81 | ESR1 (0.43) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL9279728 | 0.80 | KDM4E (0.37) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL20718779 | 0.80 | ESR1 (0.41) | ESR1ESR2PDK2KDM4EALDH1A1 | |
| SCHEMBL383004 | 0.78 | PDK2 (0.38) | ESR1ESR2PDK2KDM4EATM | |
| SCHEMBL30366005 | 0.78 | PDK2 (0.38) | ESR1ESR2PDK2KDM4EATM |
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-116621678-A | Compound, resin, polycarbonate resin, and optical molded body | 三井化学株式会社 | 2023-08-22 | — | — | CN | disclosed |
| CN-114787116-B | Compound, resin, polycarbonate resin, and optical molded body | 三井化学株式会社 | 2023-06-02 | — | — | CN | disclosed |