Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.54 |
| ▸ | CES2 | O00748 | 4/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.40 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25680268 | 0.77 | ESR1 (0.48) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL25680267 | 0.77 | ESR1 (0.48) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL11844374 | 0.76 | ESR1 (0.56) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL1035354 | 0.76 | ESR1 (0.56) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL3902058 | 0.76 | ESR1 (0.56) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL9044166 | 0.75 | CES1 (0.52) | CES1CES2ESR1ACHEMLYCD | |
| SCHEMBL23278527 | 0.73 | ESR1 (0.61) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL16933865 | 0.72 | ESR1 (0.48) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL28830738 | 0.72 | ESR1 (0.48) | CES1CES2ESR1PTGS2TSHR | |
| SCHEMBL28449348 | 0.71 | CES1 (0.48) | CES1CES2ESR1MLYCDTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114957086-A | Synthesis method and application of N-trifluoromethylsulfonyl phthalimide | 杭州师范大学 | 2022-08-30 | — | — | CN | disclosed |