Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 4/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL22859613 | 0.89 | GPBAR1 (0.32) | — | |
| SCHEMBL22859639 | 0.88 | ALDH1A1 (0.35) | ALDH1A1KMT2APDE4BRORC | |
| SCHEMBL22859644 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KMT2ARORCPTGS2 | |
| SCHEMBL19099536 | 0.84 | NR3C1 (0.34) | NR3C1 | |
| SCHEMBL22859635 | 0.84 | — | — | |
| SCHEMBL29790388 | 0.82 | LMNA (0.32) | NR3C1 | |
| SCHEMBL19099426 | 0.82 | LMNA (0.32) | NR3C1 | |
| SCHEMBL22859548 | 0.82 | ALDH1A1 (0.36) | ALDH1A1KMT2APDE4BRORC | |
| SCHEMBL22859698 | 0.81 | ALDH1A1 (0.35) | ALDH1A1KMT2APDE4BRORCCCR1 | |
| SCHEMBL20065811 | 0.80 | SMN1; SMN2 (0.31) | NR3C1 |
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-2021000736-A1 | SUBSTITUTED BENZOYL-PYRAZOLE COMPOUND, AND APPLICATION THEREOF IN AGRICULTURE | 东莞市东阳光农药研发有限公司 | 2021-01-07 | — | — | WO | disclosed |