Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CDC25B | P30305 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 2/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | RXRG | P48443 | 1/20 | 0.42 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HNF4A | P41235 | 3/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29222890 | 0.90 | PTGS2 (0.55) | PTGS2ALDH1A1GAAKMT2ATDP1 | |
| SCHEMBL29222845 | 0.80 | PTGS2 (0.47) | NPC1RAB9APTGS2ALDH1A1KMT2A | |
| SCHEMBL584940 | 0.79 | ALDH1A1 (0.55) | ALDH1A1GAAKMT2ATDP1 | |
| Biphenyl SCHEMBL27319576 | 0.79 | NPC1 (0.60) | NPC1RAB9APTGS2ALDH1A1KMT2A | |
| SCHEMBL29223121 | 0.79 | PTGS2 (0.46) | PTGS2ALDH1A1DHODHACMSDHNF4A | |
| SCHEMBL1535968 | 0.78 | TSHR (0.53) | PTGS2ALDH1A1KMT2ATDP1TSHR | |
| SCHEMBL28017583 | 0.77 | NPC1 (0.57) | NPC1RAB9APTGS2ALDH1A1KMT2A | |
| SCHEMBL246025 | 0.76 | TSHR (0.51) | NPC1RAB9APTGS2ALDH1A1GAA | |
| SCHEMBL5888693 | 0.76 | ALDH1A1 (0.49) | ALDH1A1GAAKMT2ATDP1TSHR | |
| SCHEMBL312797 | 0.76 | ALDH1A1 (0.50) | ALDH1A1GAAKMT2ATDP1TSHR |
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-118084596-A | Method for hydrogenation functionalization of photocatalytic aryl olefin compound | 山东第二医科大学 | 2024-05-28 | — | — | CN | disclosed |