Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 15/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18009330 | 1.00 | HRH3 (0.38) | HRH3SMN1; SMN2ALDH1A1MMP2ANPEP | |
| SCHEMBL18009338 | 0.88 | PKM (0.34) | SMN1; SMN2ALDH1A1POLB | |
| SCHEMBL18007444 | 0.83 | TSHR (0.41) | SMN1; SMN2ALDH1A1POLBHPGD | |
| SCHEMBL18009340 | 0.81 | GLA (0.36) | SMN1; SMN2ALDH1A1POLBKDM4E | |
| SCHEMBL18009213 | 0.81 | GLA (0.36) | SMN1; SMN2ALDH1A1POLBKDM4E | |
| SCHEMBL18009458 | 0.80 | MMP2 (0.54) | ALDH1A1MMP2ANPEP | |
| SCHEMBL18009450 | 0.80 | ATM (0.47) | ALDH1A1MMP2ANPEPKDM4E | |
| SCHEMBL18009463 | 0.79 | MMP2 (0.42) | MMP2ANPEP | |
| SCHEMBL18009202 | 0.79 | MMP2 (0.42) | MMP2ANPEP | |
| SCHEMBL18007454 | 0.78 | SMN1; SMN2 (0.34) | SMN1; SMN2ALDH1A1POLB |
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 |