Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 10/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.46 |
| ▸ | PPARG | P37231 | 8/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4560777 | 0.89 | HCRTR1 (0.54) | HCRTR1HCRTR2PPARGPPARA | |
| SCHEMBL4560318 | 0.87 | HCRTR1 (0.49) | HCRTR1HCRTR2PPARG | |
| SCHEMBL4561212 | 0.82 | HCRTR1 (0.53) | HCRTR1HCRTR2PPARGPPARA | |
| SCHEMBL3645277 | 0.77 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL2500909 | 0.75 | HCRTR1 (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL2501264 | 0.75 | HCRTR1 (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL3645275 | 0.72 | PIN1 (0.58) | HCRTR1HCRTR2 | |
| SCHEMBL2541745 | 0.72 | PPARG (0.57) | HCRTR1HCRTR2PPARGPPARAHDAC6 | |
| SCHEMBL13471010 | 0.70 | PPARG (0.57) | HCRTR1HCRTR2PPARGPPARAHDAC6 | |
| SCHEMBL2545232 | 0.69 | HCRTR1 (0.59) | 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-2009011775-A1 | AMIDOETHYL ALKYLAMINO OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2009-01-22 | — | — | WO | claimed |
| WO-2009011775-A1 | AMIDOETHYL ALKYLAMINO OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2009-01-22 | — | — | WO | disclosed |