Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 12/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 10/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17057939 | 0.89 | NPBWR1 (0.42) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL11945481 | 0.85 | NPBWR1 (0.48) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL17058305 | 0.82 | POLB (0.42) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL17058156 | 0.82 | ALDH1A1 (0.44) | NPBWR1MCHR1POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL17058362 | 0.81 | PPARG (0.41) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL17058364 | 0.80 | DCTPP1 (0.41) | MCHR1NPSR1POLBPPARGSMN1; SMN2 | |
| SCHEMBL17058465 | 0.80 | POLB (0.43) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL11945454 | 0.79 | NPBWR1 (0.47) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL17058331 | 0.79 | POLB (0.40) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL17058051 | 0.79 | POLB (0.42) | NPBWR1MCHR1CYP3A4CYP2C19NPSR1 |
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 |