Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTR5A | P47898 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.32 |
| ▸ | F10 | P00742 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL2861742 | 0.94 | SLC6A4 (0.37) | SLC6A4ALDH1A1HTR5AHTR1ADRD2 | |
| SCHEMBL13711758 | 0.92 | SLC6A4 (0.41) | SLC6A4ALDH1A1HTR5AHTR1ADRD2 | |
| SCHEMBL2861772 | 0.91 | GAA (0.36) | HTR5AF2F10LTB4R2 | |
| SCHEMBL2850998 | 0.91 | LTB4R2 (0.37) | ALDH1A1LTB4R2PTGDR2KMT2AMEN1 | |
| SCHEMBL4457062 | 0.90 | SLC6A4 (0.35) | SLC6A4ALDH1A1HTR5AHTR1ADRD2 | |
| SCHEMBL13711662 | 0.88 | SLC6A4 (0.41) | SLC6A4HTR5AHTR1ADRD2DRD4 | |
| SCHEMBL2855107 | 0.86 | PTPN11 (0.36) | SLC6A4ALDH1A1HTR5AHTR1ADRD2 | |
| SCHEMBL2861774 | 0.86 | GAA (0.38) | SLC6A4HTR5AF2F10LTB4R2 | |
| SCHEMBL2851580 | 0.86 | STAT3 (0.36) | SLC6A4ALDH1A1HTR5AHTR1ADRD2 | |
| SCHEMBL2851001 | 0.85 | LTB4R2 (0.39) | SLC6A4ALDH1A1OPRM1LTB4R2PTGDR2 |
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 |