Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 12/20 | 0.41 |
| ▸ | CNR1 | P21554 | 6/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9952979 | 0.96 | ALPL (0.53) | ALPLCNR2CNR1DGAT1AAK1 | |
| SCHEMBL23585583 | 0.95 | ALPL (0.51) | ALPLCNR2CNR1DGAT1AAK1 | |
| SCHEMBL14317989 | 0.85 | ALPL (0.59) | ALPLDGAT1AAK1ALDH1A1PIK3C3 | |
| SCHEMBL9953535 | 0.84 | ALPL (0.57) | ALPLDGAT1AAK1 | |
| SCHEMBL9953730 | 0.84 | ALPL (0.57) | ALPLDGAT1AAK1ALDH1A1HTT | |
| SCHEMBL9955177 | 0.83 | ALPL (0.56) | ALPLDGAT1AAK1ALDH1A1PIK3C3 | |
| SCHEMBL9954091 | 0.82 | ALPL (0.61) | ALPLDGAT1ALDH1A1 | |
| SCHEMBL9953472 | 0.82 | ALPL (0.62) | ALPLDGAT1AAK1PIK3C3 | |
| SCHEMBL9954766 | 0.82 | ALPL (0.56) | ALPLDGAT1ALDH1A1HTTPIK3C3 | |
| SCHEMBL9953817 | 0.82 | ALPL (0.56) | ALPLALDH1A1HTTPIK3C3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012174312-A2 | BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-12-20 | — | — | WO | disclosed |
| WO-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |