Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL256077 | 0.80 | GRM5 (0.38) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| SCHEMBL2109413 | 0.71 | GRM5 (0.39) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| SCHEMBL9967683 | 0.69 | GRM5 (0.39) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| SCHEMBL6805955 | 0.69 | PRSS1 (0.44) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| SCHEMBL29251289 | 0.69 | GRM5 (0.52) | PTGDR2GRM5ALDH1A1SMN1; SMN2 | |
| SCHEMBL2109417 | 0.68 | ALDH1A1 (0.37) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| SCHEMBL8278416 | 0.67 | PRSS1 (0.45) | PTGDR2PRSS1PRSS2PRSS3GRM5 | |
| Fluoride SCHEMBL31286347 | 0.67 | GRM5 (0.50) | PTGDR2GRM5ALDH1A1SMN1; SMN2 | |
| Charcoal, Activated SCHEMBL31286314 | 0.67 | GRM5 (0.50) | PTGDR2GRM5ALDH1A1SMN1; SMN2 | |
| SCHEMBL6810736 | 0.66 | ALDH1A1 (0.48) | PTGDR2PRSS1PRSS2PRSS3GRM5 |
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-2004060884-A1 | [4-(3-AMINOMETHYLPHENYL) PIPERIDIN-1-YL]- [5-(2-FLUOROPHENYLETHYNYL)FURAN-2-YL]-METHANONE AS AN INHIBITOR OF MAST CELL TRYPTASE | AVENTIS PHARMACEUTICALS INC. (US) | 2004-07-22 | — | — | WO | disclosed |