Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 12/20 | 0.58 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | MMP12 | P39900 | 1/20 | 0.48 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4548322 | 0.84 | HCAR2 (0.81) | HCAR2 | |
| SCHEMBL4548317 | 0.83 | HCAR2 (0.83) | HCAR2FFAR1 | |
| SCHEMBL4548396 | 0.81 | HCAR2 (0.55) | HCAR2FFAR1MMP12NAAAMAPT | |
| SCHEMBL10312490 | 0.79 | HCAR2 (0.53) | HCAR2FFAR1MMP12LTB4RNAAA | |
| SCHEMBL4548327 | 0.75 | HCAR2 (0.48) | HCAR2FFAR1MMP12NAAA | |
| SCHEMBL4548312 | 0.73 | HCAR2 (0.77) | HCAR2MAPT | |
| SCHEMBL13356363 | 0.72 | MAPT (0.80) | MAPTHTT | |
| SCHEMBL7046207 | 0.72 | HDAC1 (0.79) | FFAR1MMP12 | |
| SCHEMBL13781562 | 0.71 | HCAR2 (0.58) | HCAR2LTB4RMAPTHTT | |
| SCHEMBL13781560 | 0.71 | ALDH1A1 (0.56) | HCAR2LTB4RMAPTHTTCNR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1901731-B1 | NIACIN RECEPTOR AGONISTS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK SHARP & DOHME (US) | 2011-03-02 | — | — | EP | disclosed |