Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.70 |
| ▸ | HCRTR2 | O43614 | 20/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1586765 | 1.00 | HCRTR1 (0.70) | HCRTR1HCRTR2KCNH2CYP1A2 | |
| SCHEMBL1586455 | 0.94 | HCRTR1 (0.63) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1586888 | 0.94 | HCRTR1 (0.77) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1587417 | 0.92 | HCRTR1 (0.60) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1587421 | 0.92 | HCRTR1 (0.60) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL14973700 | 0.88 | HCRTR1 (0.57) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1586439 | 0.86 | HCRTR1 (0.56) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1586052 | 0.86 | HCRTR2 (0.68) | HCRTR1HCRTR2KCNH2 | |
| SCHEMBL1586426 | 0.84 | HCRTR1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL1672523 | 0.83 | HCRTR1 (0.86) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2491031-A1 | FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | Janssen Pharmaceutica N.V. (BE) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011050202-A1 | FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-04-28 | — | — | WO | disclosed |