Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | BCL9 | O00512 | 1/20 | 0.49 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7174053 | 0.88 | MGLL (0.57) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL19872409 | 0.88 | MGLL (0.57) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL7423587 | 0.87 | MGLL (0.53) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL7257343 | 0.86 | MGLL (0.57) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL2938526 | 0.86 | MMP9 (0.52) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL29935467 | 0.85 | MGLL (0.60) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL24058871 | 0.83 | MGLL (0.52) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL19871006 | 0.83 | MGLL (0.52) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL2747500 | 0.82 | MGLL (0.51) | MGLLGAABCL9CTNNB1ALDH1A1 | |
| SCHEMBL18375511 | 0.82 | ALDH1A1 (0.67) | MGLLGAAALDH1A1SMN1; SMN2KMT2A |
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 |