Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.53 |
| ▸ | HCRTR2 | O43614 | 20/20 | 0.53 |
| ▸ | TSPO | P30536 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786553 | 0.90 | HCRTR1 (0.54) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL4799381 | 0.88 | HCRTR1 (0.55) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL17151482 | 0.87 | HCRTR1 (0.67) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL4787721 | 0.85 | HCRTR1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL4742530 | 0.84 | HCRTR1 (0.51) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL4739196 | 0.84 | HCRTR1 (0.65) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL4786362 | 0.84 | HCRTR1 (0.68) | HCRTR1HCRTR2 | |
| SCHEMBL1398925 | 0.82 | HCRTR1 (0.59) | HCRTR1HCRTR2TSPOOPRK1HTR2B | |
| SCHEMBL4786006 | 0.82 | HCRTR1 (0.67) | HCRTR1HCRTR2 | |
| SCHEMBL3789885 | 0.81 | HCRTR1 (0.55) | HCRTR1HCRTR2TSPOOPRK1HTR2B |
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 |