Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | BCL9 | O00512 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL28744809 | 0.84 | PPARG (0.52) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL28744810 | 0.84 | PPARG (0.52) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL2747500 | 0.82 | MGLL (0.51) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL28845986 | 0.81 | PPARA (0.56) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL28845985 | 0.81 | PPARA (0.56) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL3398263 | 0.81 | MGLL (0.62) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL8477195 | 0.80 | FOLH1 (0.50) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL26915268 | 0.80 | FOLH1 (0.50) | MGLLPPARGPPARABCL9CTNNB1 | |
| SCHEMBL1219647 | 0.79 | MEN1 (0.53) | MGLLPPARGMAPTSMN1; SMN2NPC1 | |
| SCHEMBL1219646 | 0.79 | MEN1 (0.53) | MGLLPPARGMAPTSMN1; SMN2NPC1 |
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-115073442-A | Disulfide bond-containing compound, preparation method thereof, pharmaceutical composition and application | 中国医学科学院药物研究所 | 2022-09-20 | — | — | CN | disclosed |