Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 7/20 | 0.41 |
| ▸ | MAOA | P21397 | 6/20 | 0.41 |
| ▸ | AOC2 | O75106 | 5/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12060988 | 1.00 | HRH3 (0.49) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL334480 | 1.00 | HRH3 (0.49) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL1568046 | 0.81 | CA2 (0.41) | HRH3NISCH | |
| SCHEMBL30513665 | 0.81 | CA2 (0.41) | HRH3NISCH | |
| SCHEMBL6028552 | 0.81 | CA2 (0.41) | HRH3NISCH | |
| SCHEMBL9113367 | 0.81 | HRH3 (0.40) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL451210 | 0.80 | MAOB (0.41) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL434337 | 0.80 | MAOA (0.41) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL28842254 | 0.80 | MAOB (0.49) | HRH3MAOBMAOAAOC2DAO | |
| SCHEMBL6209606 | 0.80 | MAOB (0.41) | HRH3MAOBMAOAAOC2DAO |
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-112675920-B | Mono-chiral center catalyst, preparation thereof and method for catalytically synthesizing chiral alcohol compound and chiral alpha-allyl alcohol | 南方科技大学 | 2022-12-20 | — | — | CN | disclosed |