Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | CDK7 | P50613 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16199078 | 1.00 | GSK3A (0.38) | GSK3AGSK3BFLT3CDK7GRM5 | |
| SCHEMBL15401046 | 1.00 | GSK3A (0.38) | GSK3AGSK3BFLT3CDK7GRM5 | |
| SCHEMBL9970812 | 0.91 | CDK7 (0.38) | CDK7GRM5 | |
| SCHEMBL16199019 | 0.91 | GSK3A (0.38) | GSK3AGSK3BFLT3 | |
| SCHEMBL15401369 | 0.91 | CDK7 (0.38) | CDK7GRM5 | |
| SCHEMBL9977728 | 0.87 | GSK3A (0.39) | GSK3AGSK3BFLT3GRM5 | |
| SCHEMBL15399800 | 0.87 | GSK3A (0.39) | GSK3AGSK3BFLT3GRM5 | |
| SCHEMBL16199061 | 0.87 | GSK3A (0.39) | GSK3AGSK3BFLT3GRM5 | |
| SCHEMBL15400687 | 0.83 | GSK3A (0.42) | GSK3AGSK3BFLT3 | |
| SCHEMBL16199025 | 0.82 | GSK3A (0.39) | GSK3AGSK3BFLT3 |
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-2012083117-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |