Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | 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 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL17057984 | 0.85 | FFAR4 (0.32) | FFAR4ALDH1A1 | |
| SCHEMBL17058328 | 0.83 | NPC1 (0.35) | FFAR4POLBCYP3A4CYP2C19PPARG | |
| SCHEMBL17057964 | 0.82 | NPC1 (0.36) | FFAR4POLBCYP3A4CYP2C19PPARG | |
| SCHEMBL17058339 | 0.82 | NPSR1 (0.34) | POLBCYP3A4CYP2C19PPARGNCOA2 | |
| SCHEMBL17058179 | 0.80 | — | — | |
| SCHEMBL17057892 | 0.79 | ALDH1A1 (0.34) | POLBCYP3A4CYP2C19PPARGNCOA2 | |
| SCHEMBL11945606 | 0.79 | POLB (0.37) | FFAR4POLBCYP3A4CYP2C19PPARG | |
| SCHEMBL17058333 | 0.78 | POLB (0.38) | POLBCYP3A4CYP2C19PPARGNCOA2 | |
| SCHEMBL17058046 | 0.77 | NPC1 (0.38) | POLBCYP3A4CYP2C19PPARGNCOA2 | |
| SCHEMBL17058077 | 0.77 | NPC1 (0.38) | POLBCYP3A4CYP2C19PPARGNCOA2 |
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 |