Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | LPL | P06858 | 5/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1330907 | 0.89 | ROCK1 (0.41) | ROCK1LPLLIPGBACE1EGFR | |
| SCHEMBL17503870 | 0.82 | ROCK1 (0.38) | ROCK1 | |
| SCHEMBL21381097 | 0.80 | ROCK1 (0.46) | ROCK1LIPGBACE1AAK1HIF1A | |
| SCHEMBL24658457 | 0.78 | MAPK14 (0.39) | ROCK1LPLLIPG | |
| SCHEMBL578320 | 0.77 | LPL (0.43) | ROCK1LPLLIPGBACE1EGFR | |
| SCHEMBL20893513 | 0.76 | GPR119 (0.39) | ROCK1EGFR | |
| SCHEMBL20893538 | 0.76 | USP30 (0.47) | ROCK1BACE1TLR7AAK1SCN9A | |
| SCHEMBL28624112 | 0.76 | LPL (0.42) | ROCK1LPLLIPGEGFRAAK1 | |
| SCHEMBL1331278 | 0.76 | LPL (0.42) | ROCK1LPLLIPGEGFRAAK1 | |
| SCHEMBL3192898 | 0.76 | LIPG (0.45) | ROCK1LPLLIPGEGFRAAK1 |
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-3468967-A1 | COMPOUNDS CONTAINING BENZO[D][1,3]OXATHIOLE, BENZO[D][1,3]OXATHIOLE 3-OXIDE OR BENZO[D][1,3]OXATHIOLE 3,3-DIOXIDE AND METHODS/USES THEREOF AS AGONISTS OF G PROTEIN-COUPLED RECEPTOR 119 | Pramana Pharmaceuticals Inc. (CA) | 2019-04-17 | — | — | EP | disclosed |