Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.44 |
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16933865 | 0.83 | ESR1 (0.48) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL25680267 | 0.83 | ESR1 (0.48) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL25680268 | 0.83 | ESR1 (0.48) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL1035354 | 0.82 | ESR1 (0.56) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL11844374 | 0.82 | ESR1 (0.56) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL3902058 | 0.82 | ESR1 (0.56) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL23278527 | 0.79 | ESR1 (0.61) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL3684165 | 0.78 | ESR1 (0.48) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL3684167 | 0.78 | ESR1 (0.48) | ESR1CES1CES2PTGS2ALDH1A1 | |
| SCHEMBL4647631 | 0.77 | — | — |
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 |