Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | TOP1 | P11387 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | FABP1 | P07148 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13660416 | 0.88 | HRH3 (0.42) | HRH3PDE4BPDE4DTSHREP300 | |
| SCHEMBL3169447 | 0.82 | SCN9A (0.40) | HRH3PDE4BPDE4DSCN9AEP300 | |
| SCHEMBL3169440 | 0.82 | SCN9A (0.40) | HRH3PDE4BPDE4DSCN9AEP300 | |
| SCHEMBL13660311 | 0.82 | HRH3 (0.40) | HRH3PDE4BPDE4DSCN9AEP300 | |
| SCHEMBL13660459 | 0.81 | PDE4B (0.46) | HRH3PDE4BPDE4DTSHRPIK3CD | |
| SCHEMBL13660456 | 0.78 | HRH3 (0.40) | HRH3PDE4BPDE4DTSHREP300 | |
| SCHEMBL13660412 | 0.78 | HRH3 (0.40) | HRH3PDE4BPDE4DTSHREP300 | |
| SCHEMBL11920282 | 0.76 | EP300 (0.41) | HRH3PDE4BPDE4DTSHREP300 | |
| SCHEMBL2233132 | 0.76 | PDE4B (0.43) | HRH3PDE4BPDE4DTSHREP300 | |
| SCHEMBL13660461 | 0.74 | HRH3 (0.37) | HRH3PDE4BPDE4DPOLB |
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-2009121036-A2 | SUBSTITUTED ARYL PYRIMIDINONE DERIVATIVES | NEUROGEN CORPORATION (US) | 2009-10-01 | — | — | WO | disclosed |