Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 7/20 | 0.47 |
| ▸ | CA2 | P00918 | 7/20 | 0.47 |
| ▸ | CA9 | Q16790 | 7/20 | 0.47 |
| ▸ | CA12 | O43570 | 4/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.47 |
| ▸ | LGALS3 | P17931 | 13/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19680843 | 0.93 | CA1 (0.49) | CA1CA2CA9CA12CA14 | |
| SCHEMBL19680848 | 0.93 | CA1 (0.49) | CA1CA2CA9CA12CA14 | |
| SCHEMBL23319609 | 0.93 | CA1 (0.49) | CA1CA2CA9CA12CA14 | |
| SCHEMBL17993195 | 0.93 | CA1 (0.49) | CA1CA2CA9CA12CA14 | |
| SCHEMBL17964116 | 0.93 | CA1 (0.49) | CA1CA2CA9CA12CA14 | |
| SCHEMBL29673978 | 0.87 | CA1 (0.46) | CA1CA2CA9CA12CA14 | |
| SCHEMBL115044 | 0.86 | CA1 (0.56) | CA1CA2CA9CA12CA14 | |
| SCHEMBL176226 | 0.85 | CA1 (0.56) | CA1CA2CA9CA12CA14 | |
| SCHEMBL26978097 | 0.84 | LGALS3 (0.44) | CA1CA2CA9CA12CA14 | |
| SCHEMBL17993123 | 0.84 | CA1 (0.49) | CA1CA2CA9CA12CA14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018011094-A1 | ALPHA-D-GALACTOSIDE INHIBITORS OF GALECTINS | GALECTO BIOTECH AB (DK) | 2018-01-18 | — | — | WO | disclosed |