Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 7/20 | 0.44 |
| ▸ | CA12 | O43570 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | MMP14 | P50281 | 2/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 4/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL14546013 | 0.86 | GSK3B (0.47) | MMP2CA12CA1CA2CA9 | |
| SCHEMBL14051103 | 0.85 | GAA (0.37) | MMP2MAPTTP53GSK3BMMP1 | |
| SCHEMBL14545891 | 0.85 | CA12 (0.39) | MMP2CA12CA1CA2CA9 | |
| SCHEMBL14613413 | 0.84 | GSK3B (0.36) | MAPTTP53GSK3BSMN1; SMN2ALDH1A1 | |
| SCHEMBL13289501 | 0.83 | ALDH1A1 (0.47) | GSK3BALDH1A1 | |
| SCHEMBL13289270 | 0.83 | CDK2 (0.46) | MAPTGSK3BLMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL14545272 | 0.82 | GSK3B (0.36) | CA12CA2CA9MAPTGSK3B | |
| SCHEMBL14613411 | 0.82 | GSK3B (0.33) | MAPTTP53GSK3BSMN1; SMN2 | |
| SCHEMBL13289057 | 0.81 | GSK3B (0.46) | MAPTTP53GSK3BLMNASMN1; SMN2 | |
| SCHEMBL13289243 | 0.81 | GSK3B (0.46) | MAPTTP53GSK3BHTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |