Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12583243 | 0.85 | GPR84 (0.40) | GPR84ADORA1TRPA1 | |
| SCHEMBL12583259 | 0.72 | MBNL1 (0.42) | GPR84ADORA1 | |
| SCHEMBL14327778 | 0.67 | CYP1A2 (0.35) | GPR84 | |
| SCHEMBL12642413 | 0.67 | GCGR (0.50) | — | |
| SCHEMBL12583333 | 0.66 | GPR84 (0.38) | GPR84ADORA1TRPA1 | |
| SCHEMBL12583233 | 0.65 | GPR84 (0.41) | GPR84 | |
| SCHEMBL12583412 | 0.64 | GCGR (0.34) | GPR84TRPA1 | |
| SCHEMBL20036814 | 0.62 | MC4R (0.35) | — | |
| SCHEMBL20381924 | 0.62 | GPR84 (0.40) | GPR84 | |
| SCHEMBL12086034 | 0.62 | CES1 (0.44) | GPR84TRPA1 |
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-1712549-B1 | OPTICALLY ACTIVE QUATERNARY AMMONIUM SALT HAVING AXIAL ASYMMETRY AND PROCESS FOR PRODUCING ALPHA-AMINO ACID AND DERIVATIVE THEREOF WITH THE SAME | NAGASE & CO LTD (JP) | 2018-04-11 | — | — | EP | disclosed |