Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19917761 | 0.90 | LMNA (0.53) | BACE1LMNAOPRM1OPRL1ALDH1A1 | |
| SCHEMBL19917733 | 0.88 | TRPA1 (0.55) | TRPA1BACE1LMNASRCOPRM1 | |
| SCHEMBL19917752 | 0.87 | TRPA1 (0.41) | TRPA1LMNASRCOPRM1OPRL1 | |
| SCHEMBL19917766 | 0.85 | LMNA (0.44) | TRPA1LMNAOPRM1OPRL1NPC1 | |
| SCHEMBL19917760 | 0.85 | TRPA1 (0.46) | TRPA1LMNAOPRM1OPRL1 | |
| SCHEMBL19917754 | 0.85 | MAPT (0.42) | TRPA1LMNAALDH1A1TP53 | |
| SCHEMBL19917654 | 0.83 | TRPA1 (0.46) | TRPA1BACE1OPRM1OPRL1CHRM3 | |
| SCHEMBL19917758 | 0.83 | TRPA1 (0.46) | TRPA1BACE1OPRM1OPRL1CHRM3 | |
| SCHEMBL19917704 | 0.82 | TRPA1 (0.50) | TRPA1BACE1LMNASRCOPRM1 | |
| SCHEMBL16894223 | 0.82 | TRPA1 (0.56) | TRPA1LMNAALDH1A1 |
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-2900642-B1 | SUBSTITUTED SULFONAMIDE COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2018-02-28 | — | — | EP | disclosed |