Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 11/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.48 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | RORB | Q92753 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3048574 | 0.94 | RORB (0.49) | TRPV1CHRM3HCRTR1HCRTR2RORC | |
| SCHEMBL4784760 | 0.88 | HCRTR1 (0.53) | TRPV1CHRM3HCRTR1HCRTR2 | |
| SCHEMBL20040364 | 0.84 | HCRTR1 (0.64) | HCRTR1HCRTR2 | |
| SCHEMBL4740969 | 0.84 | PDK2 (0.51) | TRPV1CHRM3HCRTR1HCRTR2RORC | |
| SCHEMBL3048571 | 0.80 | RORB (0.50) | TRPV1CHRM3HCRTR1HCRTR2RORC | |
| SCHEMBL2930629 | 0.80 | RORB (0.46) | HCRTR1HCRTR2RORCRORB | |
| SCHEMBL3063297 | 0.79 | HCRTR2 (0.50) | CHRM3HCRTR1HCRTR2 | |
| SCHEMBL3058147 | 0.77 | MEN1 (0.48) | CHRM3HCRTR1HCRTR2 | |
| SCHEMBL1398831 | 0.77 | HCRTR1 (0.57) | HCRTR1HCRTR2 | |
| SCHEMBL1398834 | 0.77 | HCRTR1 (0.57) | HCRTR1HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008087611-A2 | PYRROLIDINE- AND PIPERIDINE- BIS-AMIDE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-07-24 | — | — | WO | claimed |
| WO-2008087611-A2 | PYRROLIDINE- AND PIPERIDINE- BIS-AMIDE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-07-24 | — | — | WO | disclosed |