Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 1/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31218931 | 0.81 | PARP1 (0.44) | PARP1GPR119CA1CA2CA4 | |
| SCHEMBL8575126 | 0.78 | PARP1 (0.48) | PARP1GPR119CA1CA2CA4 | |
| SCHEMBL7460398 | 0.78 | PARP1 (0.48) | PARP1GPR119CA1CA2CA4 | |
| SCHEMBL31218759 | 0.77 | PARP1 (0.52) | PARP1CA1CA2CA4CA9 | |
| SCHEMBL31476848 | 0.77 | PARP1 (0.49) | PARP1GPR119CA1CA2CA4 | |
| SCHEMBL31218714 | 0.76 | KDM4E (0.45) | PARP1GPR119CHEK2 | |
| SCHEMBL5224952 | 0.75 | PARP1 (0.50) | PARP1CA1CA2CA4CA9 | |
| SCHEMBL5224956 | 0.75 | PARP1 (0.50) | PARP1CA1CA2CA4CA9 | |
| SCHEMBL9052251 | 0.75 | PARP1 (0.50) | PARP1CA1CA2CA4CA9 | |
| SCHEMBL18129846 | 0.75 | PARP1 (0.50) | PARP1CA1CA2CA4CA9 |
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-114981241-A | Novel compound, preparation method and application thereof | 大邱庆北尖端医疗产业振兴财团 | 2022-08-30 | — | — | CN | disclosed |