Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 3/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | F11 | P03951 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL16634904 | 0.86 | LPL (0.41) | AAK1LPLLIPGF2F11 | |
| SCHEMBL16224433 | 0.79 | AAK1 (0.40) | AAK1 | |
| SCHEMBL18018421 | 0.77 | FFAR1 (0.34) | AAK1LPLLIPGFFAR1DGAT1 | |
| SCHEMBL16793507 | 0.74 | FFAR1 (0.42) | AAK1LPLLIPGF2F11 | |
| SCHEMBL16792349 | 0.74 | FFAR1 (0.42) | AAK1LPLLIPGF2F11 | |
| SCHEMBL24502686 | 0.71 | LPL (0.66) | LPLLIPGF2F11PRSS1 | |
| SCHEMBL10455086 | 0.71 | FFAR1 (0.44) | AAK1LPLLIPGFFAR1DGAT1 | |
| SCHEMBL20792664 | 0.70 | ESR2 (0.39) | AAK1LPLLIPGDGAT1 | |
| SCHEMBL18975736 | 0.70 | LPL (0.33) | LPLLIPGFFAR1 | |
| SCHEMBL18462459 | 0.69 | FFAR1 (0.43) | LPLLIPGFFAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3487853-B1 | BICYCLIC PROLINE COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2022-06-08 | — | — | EP | disclosed |
| EP-3256463-B1 | 1-(HET)ARYLSULFONYL-(PYRROLIDINE OR PIPERIDINE)-2-CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2019-10-09 | — | — | EP | disclosed |
| WO-2016128529-A1 | 1-(HET)ARYLSULFONYL-(PYRROLIDINE OR PIPERIDINE)-2-CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2016-08-18 | — | — | WO | disclosed |