Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GLP1R | P43220 | 5/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL13034763 | 0.92 | TSHR (0.43) | CES2FAAHTSHRRECQLALDH1A1 | |
| SCHEMBL12118184 | 0.88 | MEN1 (0.41) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL21440826 | 0.88 | MEN1 (0.41) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL12641023 | 0.88 | MEN1 (0.41) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL21440855 | 0.88 | MEN1 (0.41) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL19544555 | 0.88 | MEN1 (0.41) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL1669396 | 0.88 | CES2 (0.40) | CES2FAAHTSHRRECQLALDH1A1 | |
| SCHEMBL21440820 | 0.88 | GLP1R (0.40) | CES2FAAHTSHRRECQLMEN1 | |
| SCHEMBL21440818 | 0.87 | TSHR (0.39) | CES2FAAHTSHRRECQLALDH1A1 | |
| SCHEMBL21242622 | 0.87 | CES2 (0.42) | CES2FAAHTSHRRECQLALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019201123-A1 | MULTIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN PHARMACEUTICALS | 四川科伦博泰生物医药股份有限公司 | 2019-10-24 | — | — | WO | disclosed |