Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | ACP3 | P15309 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL11086531 | 0.86 | SLC6A4 (0.43) | SLC6A4MEN1KMT2AAOC3ACP3 | |
| SCHEMBL17515003 | 0.82 | IDO1 (0.36) | SLC6A4AOC3 | |
| SCHEMBL17514691 | 0.81 | SLC6A2 (0.32) | SLC6A4TDP1SLC6A2SLC6A3 | |
| SCHEMBL17514966 | 0.80 | EPAS1 (0.31) | — | |
| SCHEMBL17514722 | 0.80 | SLC6A2 (0.32) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL17514749 | 0.79 | IDO1 (0.40) | SLC6A4MEN1KMT2AACP3SLC6A2 | |
| SCHEMBL17514878 | 0.78 | — | — | |
| SCHEMBL7004930 | 0.78 | ACP3 (0.35) | SLC6A4GAAMEN1KMT2AAOC3 | |
| SCHEMBL17514598 | 0.77 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL5546380 | 0.77 | SLC6A4 (0.45) | SLC6A4AOC3ADRB2ADRB3 |
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 |