Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22897797 | 1.00 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL29559565 | 0.88 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL22897881 | 0.88 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL22897995 | 0.87 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL29559725 | 0.87 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL29559194 | 0.86 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL22897821 | 0.86 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL22897841 | 0.85 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA | |
| SCHEMBL28678317 | 0.84 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL22897989 | 0.83 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HTTRAB9ALMNA |
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-114072000-A | Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2022-02-18 | — | — | CN | disclosed |