Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL19831977 | 0.87 | TAAR1 (0.39) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL19831969 | 0.80 | SLC6A2 (0.36) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL27596 | 0.77 | TAAR1 (0.42) | TAAR1SLC6A4 | |
| SCHEMBL14478256 | 0.77 | SLC6A2 (0.52) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL8092360 | 0.75 | SLC6A2 (0.47) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL3238216 | 0.75 | TAAR1 (0.50) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL14478267 | 0.75 | TAAR1 (0.50) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL2563200 | 0.75 | TAAR1 (0.50) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL29687549 | 0.75 | TAAR1 (0.50) | TAAR1SLC6A2MAOASLC6A4SLC6A3 | |
| SCHEMBL19835584 | 0.74 | GABRA1 (0.38) | TAAR1 |
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-3661929-B1 | ISOCHROMAN COMPOUNDS AND USES THEREOF | SUNOVION PHARMACEUTICALS INC (US) | 2021-07-14 | — | — | EP | disclosed |