Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30182222 | 0.82 | ALDH1A1 (0.50) | ALDH1A1PTPN1PTPN6PTPN11KEAP1 | |
| SCHEMBL22134762 | 0.82 | ALDH1A1 (0.50) | ALDH1A1PTPN1PTPN6PTPN11KEAP1 | |
| SCHEMBL9327450 | 0.77 | ALDH1A1 (0.44) | ALDH1A1KEAP1GAAHTTL3MBTL1 | |
| SCHEMBL404482 | 0.77 | ALDH1A1 (0.44) | ALDH1A1KEAP1GAAHTT | |
| SCHEMBL434666 | 0.76 | ALDH1A1 (0.42) | ALDH1A1AHRCA3CA6CA5A | |
| SCHEMBL30111761 | 0.76 | ALDH1A1 (0.42) | ALDH1A1AHRCA3CA6CA5A | |
| SCHEMBL5272484 | 0.76 | CASP1 (0.42) | ALDH1A1PTPN1PTPN6PTPN11GAA | |
| SCHEMBL689115 | 0.74 | PTPN1 (0.41) | PTPN1PTPN6PTPN11CA9CA14 | |
| SCHEMBL12476361 | 0.74 | ALDH1A1 (0.41) | ALDH1A1KEAP1GAAHTTL3MBTL1 | |
| SCHEMBL11513981 | 0.73 | CA14 (0.46) | ALDH1A1PTPN1PTPN6PTPN11GAA |
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-117384201-A | 1-alkenyl indole compound and preparation method thereof | 鲁东大学 | 2024-01-12 | — | — | CN | disclosed |