Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28344855 | 0.74 | ITGB1 (0.32) | ALDH1A1 | |
| SCHEMBL3157514 | 0.73 | HSD11B1 (0.31) | ALDH1A1L3MBTL1 | |
| SCHEMBL5283885 | 0.69 | HSD11B1 (0.31) | L3MBTL1 | |
| SCHEMBL5302036 | 0.69 | EGFR (0.31) | L3MBTL1 | |
| SCHEMBL3154153 | 0.67 | CA1 (0.33) | — | |
| SCHEMBL12819674 | 0.66 | F2 (0.32) | — | |
| SCHEMBL4218247 | 0.65 | HTR6 (0.42) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL5412117 | 0.63 | ATM (0.42) | TSHRL3MBTL1 | |
| SCHEMBL12817603 | 0.63 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL3380599 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109574944-B | Isoxazoline derivatives and their use in agriculture | 东莞市东阳光农药研发有限公司 | 2019-12-27 | — | — | CN | disclosed |