Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.47 |
| ▸ | CA1 | P00915 | 6/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7145333 | 0.85 | CA2 (0.45) | CA2CA1CA9CA12CA4 | |
| SCHEMBL7152300 | 0.80 | CA2 (0.44) | CA2CA1CA9CA12CA4 | |
| SCHEMBL4167404 | 0.78 | CA1 (0.40) | CA2CA1CA9CA12CA4 | |
| SCHEMBL4996530 | 0.78 | CA1 (0.40) | CA2CA1CA9CA12CA4 | |
| SCHEMBL13380916 | 0.78 | CA2 (0.46) | CA2CA1CA9CA12CA4 | |
| SCHEMBL13191129 | 0.78 | CA2 (0.46) | CA2CA1CA9CA12CA4 | |
| SCHEMBL14272652 | 0.78 | CA2 (0.46) | CA2CA1CA9CA12CA4 | |
| SCHEMBL2757723 | 0.77 | CA1 (0.39) | CA2CA1CA9CA12CA4 | |
| SCHEMBL9299464 | 0.77 | CA1 (0.39) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11126008 | 0.77 | CA2 (0.41) | CA2CA1CA9CA12CA4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5599988-A | CONDENSATION, CYCLIZATION | SMITHKLINE BEECHAM CORPORATION (US) | 1997-02-04 | — | — | US | disclosed |
| WO-1996019438-A1 | AN ENANTIOSELECTIVE SYNTHESIS OF CERTAIN HYDROXYLAMINES | SMITHKLINE BEECHAM CORPORATION (US) | 1996-06-27 | — | — | WO | disclosed |