Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24538449 | 0.93 | ALDH1A1 (0.35) | ALDH1A1APLNR | |
| SCHEMBL15114434 | 0.93 | ALDH1A1 (0.35) | ALDH1A1APLNR | |
| SCHEMBL20054325 | 0.93 | ALDH1A1 (0.35) | ALDH1A1APLNR | |
| SCHEMBL21427331 | 0.78 | APLNR (0.42) | APLNR | |
| SCHEMBL26886742 | 0.77 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL25419059 | 0.76 | — | — | |
| SCHEMBL18781236 | 0.72 | — | — | |
| SCHEMBL24233879 | 0.69 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL30581233 | 0.67 | ALDH1A1 (0.44) | ALDH1A1APLNRMAPT | |
| SCHEMBL13123269 | 0.65 | ALDH1A1 (0.41) | 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-2022129914-A1 | ALKYNE DERIVATIVES AS INHIBITORS OF C-ABL | BENEVOLENTAI BIO LIMITED (GB) | 2022-06-23 | — | — | WO | disclosed |