Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 5/20 | 0.42 |
| ▸ | HTR2A | P28223 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 6/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13639028 | 0.94 | HTR2A (0.43) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL22042223 | 0.89 | TSHR (0.50) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL9198696 | 0.81 | HRH1 (0.65) | HRH1HTR2ATSHRTAAR1SLC7A5 | |
| SCHEMBL6596358 | 0.81 | TSHR (0.42) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL22042229 | 0.79 | TSHR (0.55) | HRH1HTR2ATSHRTAAR1 | |
| SCHEMBL7295713 | 0.79 | TSHR (0.41) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL4306863 | 0.79 | SIGMAR1 (0.44) | HRH1HTR2ATSHRSIGMAR1 | |
| SCHEMBL28811244 | 0.79 | TSHR (0.41) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL8995497 | 0.79 | TSHR (0.41) | HRH1HTR2ATSHRTAAR1SIGMAR1 | |
| SCHEMBL2408107 | 0.78 | TSHR (0.44) | HRH1HTR2ATSHRTAAR1SIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896419-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006129978-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2006-12-07 | — | — | WO | disclosed |