Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564387 | 0.83 | TP53 (0.35) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9564393 | 0.83 | TP53 (0.35) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9564382 | 0.78 | KMT2A (0.44) | ALDH1A1SMN1; SMN2CES2CES1GSK3B | |
| SCHEMBL9564376 | 0.76 | GAA (0.48) | ALDH1A1SMN1; SMN2LMNAMAPTMAPK1 | |
| SCHEMBL9564370 | 0.76 | GAA (0.48) | ALDH1A1SMN1; SMN2LMNAMAPTMAPK1 | |
| SCHEMBL9564386 | 0.74 | DAO (0.41) | ALDH1A1SMN1; SMN2LMNAMAPTMEN1 | |
| SCHEMBL13753928 | 0.74 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2LMNACES2CES1 | |
| SCHEMBL9564372 | 0.73 | KMT2A (0.43) | ALDH1A1SMN1; SMN2LMNAMAPTCASP1 | |
| SCHEMBL9564365 | 0.73 | KMT2A (0.43) | ALDH1A1SMN1; SMN2LMNAMAPTCASP1 | |
| SCHEMBL9564413 | 0.70 | CES2 (0.40) | CES2CES1MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0563686-A1 | Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation | BAYER AG (DE) | 1993-10-06 | — | — | EP | disclosed |