Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | DCTPP1 | Q9H773 | 4/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17058297 | 0.85 | SMN1; SMN2 (0.39) | MAPTNPC1RAB9AALDH1A1DCTPP1 | |
| SCHEMBL17058120 | 0.84 | NPC1 (0.37) | MAPTNPC1RAB9AALDH1A1DCTPP1 | |
| SCHEMBL17058476 | 0.81 | PPARG (0.37) | NPSR1PPARGNR2E3NCOR2MAPT | |
| SCHEMBL17058472 | 0.81 | NPSR1 (0.37) | NPSR1PPARGNR2E3NCOR2MAPT | |
| SCHEMBL11945629 | 0.80 | POLB (0.45) | NPSR1PPARGMAPTALDH1A1DCTPP1 | |
| SCHEMBL17058560 | 0.79 | SMN1; SMN2 (0.38) | NPSR1PPARGNR2E3NCOR2MAPT | |
| SCHEMBL17058216 | 0.79 | NPC1 (0.34) | NPSR1PPARGMAPTNPC1RAB9A | |
| SCHEMBL17058147 | 0.77 | SMN1; SMN2 (0.39) | NPSR1PPARGMAPTNPC1RAB9A | |
| SCHEMBL17058272 | 0.76 | NPSR1 (0.36) | NPSR1PPARGNR2E3NCOR2MAPT | |
| SCHEMBL17058168 | 0.76 | MAPT (0.40) | NPSR1PPARGMAPTNPC1RAB9A |
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 |