Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL15401369 | 1.00 | CDK7 (0.38) | CDK7GRM5 | |
| SCHEMBL9977700 | 0.91 | GSK3A (0.38) | CDK7GRM5 | |
| SCHEMBL15401046 | 0.91 | GSK3A (0.38) | CDK7GRM5 | |
| SCHEMBL16199078 | 0.91 | GSK3A (0.38) | CDK7GRM5 | |
| SCHEMBL15401564 | 0.87 | GRM5 (0.37) | CDK7GRM5 | |
| SCHEMBL9970820 | 0.87 | GRM5 (0.37) | CDK7GRM5 | |
| SCHEMBL16199019 | 0.83 | GSK3A (0.38) | — | |
| SCHEMBL15400659 | 0.80 | GSK3A (0.39) | — | |
| SCHEMBL15401427 | 0.80 | GSK3A (0.39) | — | |
| SCHEMBL15401452 | 0.80 | SMYD3 (0.34) | — |
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-2012083121-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |