Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | ANPEP | P15144 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL18009308 | 0.82 | KEAP1 (0.33) | HCAR2KEAP1NFE2L2ATM | |
| SCHEMBL11779531 | 0.81 | CHRM2 (0.42) | — | |
| SCHEMBL18009397 | 0.80 | ALDH1A1 (0.37) | ATM | |
| SCHEMBL18009208 | 0.80 | HCAR2 (0.35) | HCAR2KEAP1NFE2L2MMP2ANPEP | |
| SCHEMBL18009202 | 0.72 | MMP2 (0.42) | HCAR2KEAP1NFE2L2MMP2ANPEP | |
| SCHEMBL18009463 | 0.72 | MMP2 (0.42) | HCAR2KEAP1NFE2L2MMP2ANPEP | |
| SCHEMBL18009212 | 0.67 | MMP2 (0.34) | HCAR2KEAP1NFE2L2MMP2ANPEP | |
| SCHEMBL18009399 | 0.67 | MMP2 (0.34) | HCAR2KEAP1NFE2L2MMP2ANPEP | |
| SCHEMBL11770755 | 0.67 | PIK3CA (0.37) | ATM | |
| SCHEMBL11773555 | 0.66 | CHRM2 (0.43) | ATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016127186-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE | NGUYEN MARK QUANG (US) | 2016-08-11 | — | — | WO | disclosed |