Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.31 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.30 |
| ▸ | SLC2A3 | P11169 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.30 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | NCOA3 | Q9Y6Q9 | 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 | |
|---|---|---|---|---|
| SCHEMBL14080902 | 0.87 | NPBWR1 (0.31) | NPBWR1MCHR1 | |
| SCHEMBL17058559 | 0.87 | POLB (0.33) | NPBWR1SLC2A1SLC2A3POLBCYP3A4 | |
| SCHEMBL17057972 | 0.86 | POLB (0.33) | ALDH1A1SLC2A1SLC2A3POLBCYP3A4 | |
| SCHEMBL17058289 | 0.85 | NPBWR1 (0.34) | ALDH1A1NPBWR1MCHR1SLC2A1SLC2A3 | |
| SCHEMBL17057817 | 0.83 | SMN1; SMN2 (0.38) | ALDH1A1NPBWR1MCHR1POLBCYP3A4 | |
| SCHEMBL17058519 | 0.82 | SLC2A1 (0.32) | SLC2A1SLC2A3POLBCYP3A4CYP2C19 | |
| SCHEMBL17058174 | 0.82 | POLB (0.34) | ALDH1A1POLBCYP3A4CYP2C19PPARG | |
| SCHEMBL17057853 | 0.82 | SMN1; SMN2 (0.35) | ALDH1A1NPBWR1MCHR1SLC2A1SLC2A3 | |
| SCHEMBL17058487 | 0.81 | SMN1; SMN2 (0.35) | ALDH1A1MCHR1POLB | |
| SCHEMBL17058535 | 0.81 | SMN1; SMN2 (0.35) | ALDH1A1SLC2A1SLC2A3POLBCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |