Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.47 |
| ▸ | POLH | Q9Y253 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9958125 | 0.86 | ADORA3 (0.54) | ACE2ADORA3ABCG2ABCB1ABCC1 | |
| SCHEMBL13707581 | 0.81 | ACE2 (0.76) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL14594144 | 0.78 | ACE2 (0.83) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL12371412 | 0.77 | ACE2 (0.69) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL29369818 | 0.77 | ACE2 (0.69) | ACE2ADORA3PTGS1KDM4EMEN1 | |
| SCHEMBL13445534 | 0.77 | ACE2 (0.69) | ACE2ADORA3PTGS1KDM4EMEN1 | |
| SCHEMBL25308089 | 0.76 | ACE2 (0.68) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL17656830 | 0.76 | ACE2 (0.68) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL12866149 | 0.75 | ACE2 (0.78) | ACE2ADORA3PTGS1ABCG2ABCB1 | |
| SCHEMBL13911071 | 0.75 | ACHE (0.53) | KDM4EMEN1CYP3A4CYP2C9KMT2A |
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-2020125478-A1 | DRUG COMPOUND, PREPARATION THEREFOR, AND APPLICATION THEREOF | 上海槐丰生物科技有限公司 | 2020-06-25 | — | — | WO | disclosed |