Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29987487 | 0.83 | TSHR (0.31) | — | |
| SCHEMBL30124886 | 0.81 | PTPN1 (0.33) | KMT2ASLC6A2 | |
| SCHEMBL30125098 | 0.80 | SLC6A3 (0.37) | KMT2ASLC6A3SLC6A4SLC6A2 | |
| SCHEMBL30124758 | 0.80 | CCR2 (0.35) | KMT2ASLC6A3SLC6A2 | |
| SCHEMBL30124933 | 0.79 | HSD11B1 (0.31) | — | |
| SCHEMBL30124641 | 0.78 | CCR2 (0.36) | SLC6A3SLC6A4SLC6A2CES2CES1 | |
| SCHEMBL30124707 | 0.78 | PKM (0.35) | KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL30710190 | 0.77 | CHRNA1 (0.31) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL30124913 | 0.75 | CA12 (0.33) | — | |
| SCHEMBL30124958 | 0.75 | HSD11B1 (0.35) | KMT2A |
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-115403494-B | Method for synthesizing beta-hydroxy sulfone derivative by oxygen-initiated olefin double-functionalization under mild condition | 湘潭大学 | 2024-01-02 | — | — | CN | disclosed |