Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 11/20 | 0.58 |
| ▸ | MTNR1B | P49286 | 11/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31290509 | 0.78 | MAPT (0.45) | MTNR1AMTNR1BTSHRL3MBTL1ALDH1A1 | |
| SCHEMBL9866486 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTKMT2A | |
| Iodide SCHEMBL9865687 | 0.77 | SLC6A3 (0.33) | MTNR1AMTNR1BTSHRL3MBTL1MAPT | |
| SCHEMBL9866492 | 0.77 | NPC1 (0.37) | MTNR1AMTNR1BTSHRALDH1A1MAPT | |
| SCHEMBL31290434 | 0.76 | CYSLTR2 (0.50) | ALDH1A1MAPT | |
| SCHEMBL31290421 | 0.75 | MAPT (0.50) | L3MBTL1ALDH1A1MAPTKMT2ASLC6A3 | |
| SCHEMBL31290475 | 0.74 | CA12 (0.49) | TSHRALDH1A1MAPTKMT2ASLC6A3 | |
| SCHEMBL31290531 | 0.74 | SLC6A3 (0.55) | MAPTKMT2ASLC6A3 | |
| SCHEMBL4219824 | 0.74 | MTNR1A (1.00) | MTNR1AMTNR1BCASR | |
| SCHEMBL31290526 | 0.74 | HPGD (0.51) | L3MBTL1ALDH1A1MAPTKMT2A |
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-111377841-B | Method for inducing asymmetric mercapto-alkene click reaction through chiral inorganic liquid crystal carrier | 中国科学技术大学 | 2021-07-06 | — | — | CN | disclosed |
| CN-111377841-A | Method for inducing asymmetric mercapto-alkene click reaction through chiral inorganic liquid crystal carrier | 中国科学技术大学 | 2020-07-07 | — | — | CN | disclosed |