Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | MERTK | Q12866 | 1/20 | 0.44 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | USP7 | Q93009 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20038436 | 0.85 | ALDH1A1 (0.44) | ALDH1A1FLT3MERTKGAS6KDM4E | |
| SCHEMBL20255713 | 0.85 | ALDH1A1 (0.44) | ALDH1A1FLT3MERTKGAS6KDM4E | |
| SCHEMBL22030910 | 0.83 | CHRNB2 (0.43) | ALDH1A1FLT3MERTKGAS6PIM3 | |
| SCHEMBL20249409 | 0.83 | ALDH1A1 (0.42) | ALDH1A1FLT3MERTKGAS6NR1H2 | |
| SCHEMBL20249415 | 0.83 | ALDH1A1 (0.42) | ALDH1A1FLT3MERTKGAS6NR1H2 | |
| SCHEMBL19214374 | 0.81 | NR1H2 (0.51) | NR1H2NR1H3GABRA1GABRA5 | |
| SCHEMBL28290433 | 0.81 | KDM4E (0.55) | KDM4EPOLBHRH3CHRNB2CHRNA4 | |
| SCHEMBL29050285 | 0.77 | ALDH1A1 (0.44) | ALDH1A1KDM4EPOLBKCNH2HRH3 | |
| SCHEMBL28865568 | 0.77 | ALDH1A1 (0.41) | ALDH1A1FLT3MERTKGAS6KDM4E | |
| SCHEMBL7489800 | 0.77 | ALDH1A1 (0.59) | ALDH1A1FLT3MERTKGAS6KDM4E |
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-2016194831-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | 帝人ファーマ株式会社 | 2016-12-08 | — | — | WO | disclosed |