Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 7/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.38 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | MC3R | P41968 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13040920 | 0.93 | CASR (0.41) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL3734669 | 0.93 | CASR (0.41) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL13040756 | 0.89 | CASR (0.40) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL13040742 | 0.89 | CASR (0.40) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL3728937 | 0.88 | CASR (0.43) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL13040741 | 0.88 | CASR (0.39) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL13040750 | 0.86 | CASR (0.41) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL13040692 | 0.83 | CASR (0.43) | CASRADRA2CSLC6A2HTR2CSLC6A4 | |
| SCHEMBL3734667 | 0.83 | AURKA (0.41) | CASREPHX2 | |
| SCHEMBL13040835 | 0.82 | CASR (0.38) | CASRADRA2CSLC6A2HTR2CSLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008019690-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2008-02-21 | — | — | WO | disclosed |