Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | FOS | P01100 | 5/20 | 0.49 |
| ▸ | JUN | P05412 | 5/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 5/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL23574966 | 0.85 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL5014336 | 0.85 | FOS (0.60) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL3572484 | 0.85 | ALDH1A1 (0.78) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL22355099 | 0.83 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL6017125 | 0.82 | FOS (0.61) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL29635221 | 0.82 | PDGFRB (0.54) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL22712428 | 0.81 | NPC1 (0.57) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL22745548 | 0.80 | RAB9A (0.58) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL22658054 | 0.80 | NPC1 (0.56) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL22712437 | 0.80 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 |
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-108707151-B | Pyrimido-pyridazinone compounds and uses thereof | 阿萨纳生物科技有限责任公司 | 2022-06-03 | — | — | CN | disclosed |