Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | CRHBP | P24387 | 1/20 | 0.53 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.53 |
| ▸ | BCL9 | O00512 | 1/20 | 0.52 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18078263 | 0.88 | MGLL (0.67) | MGLLMAPTCRHBPCRHR2BCL9 | |
| SCHEMBL7174053 | 0.87 | MGLL (0.57) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL19872409 | 0.85 | MGLL (0.57) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL29935348 | 0.85 | MGLL (0.57) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL7423587 | 0.84 | MGLL (0.53) | MGLLBCL9CTNNB1HTR2AGAA | |
| SCHEMBL7257343 | 0.83 | MGLL (0.57) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL24058871 | 0.83 | MGLL (0.52) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL19871006 | 0.83 | MGLL (0.52) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL8403807 | 0.82 | MGLL (0.60) | MGLLMAPTBCL9CTNNB1HTR2A | |
| SCHEMBL12150063 | 0.81 | CYP1A2 (0.55) | MAPTCRHBPCRHR2GAAKMT2A |
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 |