Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28794509 | 0.85 | AKR1C4 (0.55) | ALDH1A1KDM4EGAAGLAMAPT | |
| SCHEMBL24397958 | 0.83 | SCN9A (0.44) | ALDH1A1KDM4EGAAGLAMAPT | |
| SCHEMBL28219995 | 0.83 | KDM4E (0.59) | ALDH1A1KDM4EGAAGLAMAPT | |
| SCHEMBL29129843 | 0.81 | ABL1 (0.49) | ALDH1A1KDM4EGAAGLAMAPT | |
| SCHEMBL24397796 | 0.80 | HPGD (0.48) | ALDH1A1KDM4EGAAGLAMAPT | |
| SCHEMBL28451506 | 0.78 | ALDH1A1 (0.48) | ALDH1A1KDM4EGAATSHRSMN1; SMN2 | |
| SCHEMBL29606233 | 0.78 | ALDH1A1 (0.48) | ALDH1A1KDM4EGAATSHRSMN1; SMN2 | |
| SCHEMBL24397792 | 0.78 | LMNA (0.54) | ALDH1A1KDM4EMAPTTSHRSMN1; SMN2 | |
| SCHEMBL24397879 | 0.76 | CRHR1 (0.49) | ALDH1A1MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL2090288 | 0.76 | RAPGEF4 (0.46) | ALDH1A1GAAMAPTTP53TSHR |
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-117285508-A | Preparation method of pyridyl pyrazole amide compound and intermediate thereof | 湖南化工研究院有限公司 | 2023-12-26 | — | — | CN | disclosed |