Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 11/20 | 0.64 |
| ▸ | CA1 | P00915 | 11/20 | 0.64 |
| ▸ | CA2 | P00918 | 11/20 | 0.64 |
| ▸ | CA9 | Q16790 | 11/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.47 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10288889 | 0.87 | CA12 (0.65) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9960688 | 0.84 | CA12 (0.68) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9954144 | 0.82 | ALDH1A1 (0.71) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953988 | 0.82 | CA12 (0.68) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953725 | 0.80 | CA12 (0.65) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9954597 | 0.79 | CA12 (0.64) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953093 | 0.78 | CA12 (0.62) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953653 | 0.78 | CA12 (0.51) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953998 | 0.77 | CA12 (0.58) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9952357 | 0.76 | CA12 (0.57) | CA12CA1CA2CA9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |