Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | NAMPT | P43490 | 4/20 | 0.55 |
| ▸ | GRM5 | P41594 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | DGAT2 | Q96PD7 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL23387883 | 1.00 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1MAPTHTTNAMPT | |
| SCHEMBL5083468 | 0.92 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1MAPTHTTGRM5 | |
| SCHEMBL29722613 | 0.88 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1MAPTHTTGRM5 | |
| SCHEMBL1116654 | 0.88 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1MAPTHTTGRM5 | |
| SCHEMBL5777586 | 0.85 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1MAPTHTTGRM5 | |
| SCHEMBL1116630 | 0.84 | ALDH1A1 (0.78) | ALDH1A1L3MBTL1MAPTHTTGRM5 | |
| SCHEMBL27962651 | 0.82 | NAMPT (0.50) | NAMPTHDAC1HDAC6HPGDSDGAT2 | |
| SCHEMBL19877022 | 0.82 | NAMPT (0.50) | NAMPTHDAC1HDAC6HPGDSDGAT2 | |
| SCHEMBL13868569 | 0.82 | NAMPT (0.61) | ALDH1A1HTTNAMPTSMN1; SMN2RAB9A | |
| SCHEMBL29167802 | 0.82 | NAMPT (0.61) | ALDH1A1HTTNAMPTSMN1; SMN2RAB9A |
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-107344936-B | Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof | 上海赛默罗生物科技有限公司 | 2022-06-03 | — | — | CN | disclosed |