Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 19/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31474255 | 0.82 | TP53 (0.38) | ALDH1A1MAPTIRAK4 | |
| SCHEMBL31474105 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTIRAK4 | |
| SCHEMBL31474221 | 0.81 | LIPE (0.32) | ALDH1A1MAPT | |
| SCHEMBL31474190 | 0.80 | BTK (0.34) | ALDH1A1MAPT | |
| SCHEMBL31474008 | 0.79 | NPC1 (0.33) | ALDH1A1 | |
| SCHEMBL31473998 | 0.77 | LIPE (0.36) | ALDH1A1MAPT | |
| SCHEMBL27003891 | 0.76 | LIPE (0.39) | — | |
| SCHEMBL16754856 | 0.76 | BTK (0.45) | — | |
| SCHEMBL29520132 | 0.76 | BTK (0.45) | — | |
| SCHEMBL31474086 | 0.76 | ALDH1A1 (0.36) | ALDH1A1MAPT |
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-2025061148-A1 | HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2025-03-27 | — | — | WO | disclosed |