Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.72 |
| ▸ | CASP1 | P29466 | 1/20 | 0.72 |
| ▸ | CASP7 | P55210 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28410934 | 0.88 | CFTR (0.61) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28410236 | 0.86 | ALDH1A1 (0.71) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28285612 | 0.84 | MAPK1 (0.52) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28408388 | 0.83 | LMNA (0.55) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28408390 | 0.83 | LMNA (0.55) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28406737 | 0.81 | MAPT (0.59) | MAPK1CASP1CASP7MAPTTP53 | |
| Methane SCHEMBL28285604 | 0.80 | MAPT (0.58) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL28285611 | 0.80 | MAPT (0.58) | MAPK1CASP1CASP7MAPTTP53 | |
| SCHEMBL29847379 | 0.78 | CASP1 (0.57) | MAPK1CASP1CASP7ALDH1A1KDM4E | |
| SCHEMBL6581741 | 0.78 | CASP1 (0.57) | MAPK1CASP1CASP7ALDH1A1KDM4E |
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-109535086-B | Synthetic method of quinoxaline-2 (1H) -ketone C-3 carboxylate compound | 湖南科技学院 | 2020-05-05 | — | — | CN | disclosed |