Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | TDO2 | P48775 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | RPS6KB2 | Q9UBS0 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31359266 | 0.85 | RPS6KB2 (0.54) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 | |
| SCHEMBL29445837 | 0.83 | TDO2 (0.55) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 | |
| SCHEMBL1448395 | 0.83 | TDO2 (0.55) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 | |
| SCHEMBL30103541 | 0.82 | TDO2 (0.54) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 | |
| SCHEMBL509927 | 0.74 | ADORA2A (0.54) | ALDH1A1MAPTRAB9AL3MBTL1BLM | |
| SCHEMBL29923403 | 0.74 | PLAU (0.60) | ALDH1A1MAPTRAB9AL3MBTL1KDM4E | |
| SCHEMBL199273 | 0.74 | PLAU (0.60) | ALDH1A1MAPTRAB9AL3MBTL1KDM4E | |
| SCHEMBL5999887 | 0.73 | CFTR (0.41) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 | |
| SCHEMBL28421930 | 0.72 | CYP2A6 (0.45) | ALDH1A1MAPTRAB9AL3MBTL1KDM4E | |
| SCHEMBL28414868 | 0.72 | IDO1 (0.46) | ALDH1A1MAPTRAB9ATDO2L3MBTL1 |
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-116874421-A | Method for synthesizing 1,1' -biisoquinoline derivative from 2, 2-dimethyl-4, 5-diaryl-2H-imidazole | 桂林理工大学 | 2023-10-13 | — | — | CN | disclosed |