Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | ITK | Q08881 | 9/20 | 0.34 |
| ▸ | INSR | P06213 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22013625 | 0.74 | HRH3 (0.39) | HRH3HRH4PARP1ITKINSR | |
| SCHEMBL21962214 | 0.69 | HRH3 (0.48) | HRH3HRH4PARP1LMNAMAPT | |
| SCHEMBL21962543 | 0.69 | HRH3 (0.38) | HRH3HRH4PARP1ITKLTA4H | |
| SCHEMBL22012518 | 0.67 | HRH3 (0.54) | HRH3HRH4PARP1LTA4H | |
| SCHEMBL22013710 | 0.65 | HRH3 (0.46) | HRH3HRH4PARP1LTA4HLMNA | |
| SCHEMBL11619570 | 0.62 | HRH3 (0.55) | HRH3HRH4PARP1ITKINSR | |
| SCHEMBL29957867 | 0.62 | HRH3 (0.55) | HRH3HRH4PARP1ITKLTA4H | |
| SCHEMBL6618848 | 0.62 | HRH3 (0.45) | HRH3HRH4PARP1LTA4H | |
| Hydrochloric Acid SCHEMBL11621117 | 0.61 | HRH3 (0.54) | HRH3HRH4PARP1ITKINSR | |
| SCHEMBL12666608 | 0.60 | HRH3 (0.70) | HRH3HRH4PARP1LTA4HLMNA |
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-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |