Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13003089 | 0.88 | GAA (0.42) | GAATSHRALDH1A1DGAT1 | |
| SCHEMBL9006777 | 0.87 | GAA (0.46) | GAATSHRALDH1A1LMNAHSD17B10 | |
| SCHEMBL17356885 | 0.84 | GAA (0.44) | GAATSHRALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL18156057 | 0.82 | GAA (0.42) | GAATSHRALDH1A1 | |
| SCHEMBL13434035 | 0.82 | GAA (0.42) | GAATSHRALDH1A1 | |
| SCHEMBL13827068 | 0.82 | GAA (0.42) | GAATSHRALDH1A1 | |
| SCHEMBL17300339 | 0.82 | ALDH1A1 (0.44) | GAATSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL17693105 | 0.80 | GAA (0.37) | GAAALDH1A1DGAT1 | |
| SCHEMBL10593835 | 0.80 | GAA (0.41) | GAATSHRALDH1A1 | |
| SCHEMBL2185156 | 0.79 | GAA (0.50) | GAATSHRALDH1A1LMNAHSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114907385-A | Nitrogen heteroaryl compound, preparation method and application thereof | 上海青煜医药科技有限公司 | 2022-08-16 | — | — | CN | disclosed |
| CN-112955453-B | Pyrazolopyrimidine derivatives as selective Trk inhibitors | 山东绿叶制药有限公司 | 2022-04-19 | — | — | CN | disclosed |
| US-20100311941-A1 | COPOLYMERIZATION OF EPOXIDES AND CYCLIC ANHYDRIDES | CORNELL UNIVERSITY | 2010-12-09 | — | — | US | disclosed |
| US-5104503-A | Radiation in presence of group 2b metal | YALE UNIVERSITY (US) | 1992-04-14 | — | — | US | disclosed |