Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 5/20 | 0.36 |
| ▸ | PGR | P06401 | 3/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.30 |
| ▸ | MET | P08581 | 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 | |
|---|---|---|---|---|
| SCHEMBL6191314 | 0.89 | ABL1 (0.33) | CHRM3MET | |
| SCHEMBL17514815 | 0.80 | NOTUM (0.41) | — | |
| SCHEMBL16719652 | 0.80 | TUBB4A (0.40) | — | |
| SCHEMBL17514938 | 0.79 | PTGS2 (0.46) | CHRM3 | |
| SCHEMBL17514964 | 0.79 | MAOB (0.34) | CHRM3 | |
| SCHEMBL17514584 | 0.78 | TUBB4A (0.33) | — | |
| SCHEMBL17514813 | 0.78 | SLC6A4 (0.42) | — | |
| SCHEMBL6985969 | 0.78 | SLC6A4 (0.42) | — | |
| SCHEMBL17514958 | 0.77 | DPP4 (0.35) | — | |
| SCHEMBL17514992 | 0.76 | HSD11B1 (0.35) | CHRM3 |
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-2016026830-A1 | NOVEL FUNGICIDAL PYRAZOLE DERIVATIVES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-02-25 | — | — | WO | disclosed |