Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | DUT | P33316 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2251477 | 0.84 | NOTUM (0.36) | NOTUMADRA1DADRA1AADRA1B | |
| SCHEMBL2251637 | 0.82 | NOTUM (0.34) | NOTUMADRA1DADRA1AADRA1B | |
| SCHEMBL5099353 | 0.78 | PPARA (0.38) | PPARA | |
| SCHEMBL5792465 | 0.78 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL5099337 | 0.73 | NOTUM (0.40) | NOTUMPPARAADRA1DADRA1AADRA1B | |
| SCHEMBL12144860 | 0.73 | ALDH1A1 (0.37) | DUT | |
| SCHEMBL5788622 | 0.73 | CA12 (0.36) | — | |
| SCHEMBL29234853 | 0.71 | HCAR2 (0.42) | PPARADUT | |
| SCHEMBL3257255 | 0.70 | ALDH1A1 (0.36) | DUT | |
| SCHEMBL8599814 | 0.70 | NR1I2 (0.42) | PPARADUT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1704143-A1 | MALONONITRILE COMPOUND AS PESTICIDES | Sumitomo Chemical Company, Limited (JP) | 2006-09-27 | — | — | EP | disclosed |
| WO-2005068432-A1 | MALONONITRILE COMPOUND AS PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2005-07-28 | — | — | WO | disclosed |