Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 20/20 | 0.77 |
| ▸ | HCRTR1 | O43613 | 18/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.77 |
| ▸ | HTR2A | P28223 | 1/20 | 0.77 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Mk-1064 SCHEMBL30593431 | 0.87 | HCRTR2 (1.00) | HCRTR2HCRTR1CYP3A4HTR2AHTR1A | |
| Mk-1064 SCHEMBL3486358 | 0.87 | HCRTR2 (1.00) | HCRTR2HCRTR1CYP3A4HTR2AHTR1A | |
| SCHEMBL3486353 | 0.84 | HCRTR2 (0.83) | HCRTR2HCRTR1CYP3A4HTR2A | |
| SCHEMBL3486920 | 0.84 | HCRTR2 (0.83) | HCRTR2HCRTR1CYP3A4HTR2A | |
| SCHEMBL3486550 | 0.82 | HCRTR2 (0.79) | HCRTR2HCRTR1CYP3A4HTR2A | |
| SCHEMBL3487239 | 0.79 | HCRTR2 (0.75) | HCRTR2HCRTR1CYP3A4HTR2A | |
| SCHEMBL15894168 | 0.79 | HCRTR2 (0.85) | HCRTR2HCRTR1CYP3A4HTR2AHTR1A | |
| SCHEMBL2248733 | 0.76 | HCRTR2 (0.84) | HCRTR2HCRTR1CYP3A4HTR2A | |
| SCHEMBL2280032 | 0.76 | HCRTR2 (0.82) | HCRTR2HCRTR1CYP3A4HTR2AHTR1A | |
| SCHEMBL3486460 | 0.76 | HCRTR2 (0.79) | HCRTR2HCRTR1CYP3A4HTR2AHTR1A |
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-2744481-A1 | USE OF INORGANIC MATRIX AND ORGANIC POLYMER COMBINATIONS FOR PREPARING STABLE AMORPHOUS DISPERSIONS | Merck Sharp & Dohme Corp. (US) | 2014-06-25 | — | — | EP | claimed |
| WO-2013025449-A1 | USE OF INORGANIC MATRIX AND ORGANIC POLYMER COMBINATIONS FOR PREPARING STABLE AMORPHOUS DISPERSIONS | MERCK SHARP & DOHME CORP. (US) | 2013-02-21 | — | — | WO | claimed |