Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 17/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 17/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9957138 | 0.83 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL9954554 | 0.80 | HCRTR1 (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL9955934 | 0.78 | HCRTR1 (0.48) | HCRTR1HCRTR2 | |
| SCHEMBL9957650 | 0.78 | HCRTR1 (0.56) | HCRTR1HCRTR2LMNATP53 | |
| SCHEMBL9957647 | 0.78 | HCRTR1 (0.56) | HCRTR1HCRTR2LMNATP53 | |
| SCHEMBL9957155 | 0.77 | HCRTR1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL9954517 | 0.77 | HCRTR1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL9957391 | 0.77 | HCRTR1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL9956933 | 0.76 | HCRTR1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL9957419 | 0.76 | HCRTR1 (0.42) | 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-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | claimed |
| WO-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |