Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 11/20 | 0.68 |
| ▸ | CA1 | P00915 | 11/20 | 0.68 |
| ▸ | CA2 | P00918 | 11/20 | 0.68 |
| ▸ | CA9 | Q16790 | 11/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.50 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 4/20 | 0.48 |
| ▸ | XDH | P47989 | 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 | |
|---|---|---|---|---|
| SCHEMBL9953093 | 0.88 | CA12 (0.62) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9954144 | 0.85 | ALDH1A1 (0.71) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953988 | 0.85 | CA12 (0.68) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953692 | 0.84 | CA12 (0.64) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL6283951 | 0.84 | PDE7A (0.71) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953725 | 0.83 | CA12 (0.65) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9953998 | 0.82 | CA12 (0.58) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9954597 | 0.82 | CA12 (0.64) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9952357 | 0.81 | CA12 (0.57) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL23045531 | 0.80 | ALDH1A1 (0.71) | 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 |