Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.37 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 5/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | SPR | P35270 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4031716 | 0.92 | SCN8A (0.36) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL4034238 | 0.88 | SCN8A (0.34) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL4033961 | 0.88 | MPO (0.41) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL3943920 | 0.85 | ADAM17 (0.39) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL13902848 | 0.85 | ADAM17 (0.39) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL4035244 | 0.85 | SCN8A (0.39) | SCN8ASCN10AHTR1ASLC6A4HTR2A | |
| SCHEMBL4035538 | 0.81 | ADAM17 (0.38) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL13902839 | 0.77 | HTR1A (0.40) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL3934212 | 0.77 | HTR1A (0.40) | SCN8ASCN10AHTR1ASLC6A4ADAM17 | |
| SCHEMBL13902842 | 0.75 | ADAM17 (0.39) | SCN8ASCN10AHTR1ASLC6A4ADAM17 |
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-2019102-A1 | Alkylacetylene substituted Acyltryptophanols | Bayer Schering Pharma AG (DE) | 2009-01-28 | — | — | EP | disclosed |