Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 8/20 | 0.81 |
| ▸ | HTR7 | P34969 | 5/20 | 0.53 |
| ▸ | PRKCA | P17252 | 1/20 | 0.53 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 4/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL8023371 | 0.87 | KCNH2 (0.71) | KCNH2HTR7PRKCAPTPN2DRD3 | |
| SCHEMBL1769673 | 0.87 | KCNH2 (1.00) | KCNH2HTR7PRKCAPTPN2DRD4 | |
| SCHEMBL1769634 | 0.87 | KCNH2 (1.00) | KCNH2HTR7PRKCAPTPN2DRD3 | |
| SCHEMBL13016557 | 0.85 | KCNH2 (0.74) | KCNH2HTR7PRKCAPTPN2DRD3 | |
| SCHEMBL8023280 | 0.84 | KCNH2 (0.67) | KCNH2HTR7PRKCAPTPN2DRD4 | |
| SCHEMBL30153039 | 0.83 | KCNH2 (0.71) | KCNH2HTR7PRKCAPTPN2GAA | |
| SCHEMBL1769593 | 0.82 | KCNH2 (0.70) | KCNH2HTR7PRKCAPTPN2 | |
| SCHEMBL1769581 | 0.81 | KCNH2 (0.75) | KCNH2HTR7PRKCAPTPN2DRD3 | |
| SCHEMBL1769772 | 0.80 | KCNH2 (0.66) | KCNH2HTR7PRKCAPTPN2DRD3 | |
| SCHEMBL1769582 | 0.79 | KCNH2 (0.65) | KCNH2HTR7PRKCAPTPN2DRD3 |
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-2244577-B1 | QUINOLIZIDINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK SHARP & DOHME (US) | 2012-10-31 | — | — | EP | disclosed |
| WO-2009094279-A1 | QUINOLIZIDINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2009-07-30 | — | — | WO | disclosed |