Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | HTR5A | P47898 | 7/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2859640 | 0.86 | SLC6A4 (0.38) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2855107 | 0.81 | PTPN11 (0.36) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2858908 | 0.81 | PTPN11 (0.36) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL13513480 | 0.78 | SLC6A4 (0.45) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL1734729 | 0.77 | RARB (0.46) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL4457062 | 0.76 | SLC6A4 (0.35) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2868663 | 0.76 | LTB4R2 (0.34) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2875007 | 0.74 | SLC6A4 (0.43) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2859740 | 0.74 | HTR5A (0.35) | SLC6A4HTR5ACNR2LTB4R2PTPN11 | |
| SCHEMBL2853646 | 0.73 | PTPN11 (0.39) | POLBALDH1A1LTB4R2MMP2MMP9 |
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-1654247-B1 | ALKYNYL ARYL CARBOXAMIDES | MERCK SERONO SA (CH) | 2010-01-20 | — | — | EP | disclosed |