Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1351105 | 0.80 | DGAT1 (0.41) | DGAT1CYP3A4MAPT | |
| SCHEMBL17514469 | 0.78 | CES2 (0.37) | TDP1MAPT | |
| SCHEMBL17514459 | 0.76 | SELL (0.39) | TSHR | |
| SCHEMBL903548 | 0.73 | CYP3A4 (0.48) | DGAT1CYP3A4MAPT | |
| SCHEMBL30016591 | 0.73 | CYP3A4 (0.48) | DGAT1CYP3A4MAPT | |
| SCHEMBL18378338 | 0.72 | CYP3A4 (0.48) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL24252415 | 0.72 | DGAT1 (0.39) | DGAT1CYP3A4MAPT | |
| SCHEMBL30633750 | 0.72 | DGAT1 (0.35) | DGAT1CYP3A4MAPT | |
| SCHEMBL7765933 | 0.72 | DGAT1 (0.33) | DGAT1CYP3A4TSHRTDP1 | |
| SCHEMBL516974 | 0.72 | DGAT1 (0.42) | DGAT1MAPT |
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 |