Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15401564 | 1.00 | GRM5 (0.37) | GRM5CDK7BTK | |
| SCHEMBL9977728 | 0.91 | GSK3A (0.39) | GRM5 | |
| SCHEMBL15399800 | 0.91 | GSK3A (0.39) | GRM5 | |
| SCHEMBL16199061 | 0.91 | GSK3A (0.39) | GRM5 | |
| SCHEMBL9967246 | 0.88 | CDK7 (0.43) | CDK7 | |
| SCHEMBL15401369 | 0.87 | CDK7 (0.38) | GRM5CDK7 | |
| SCHEMBL9970812 | 0.87 | CDK7 (0.38) | GRM5CDK7 | |
| SCHEMBL9970823 | 0.81 | BTK (0.34) | GRM5CDK7BTK | |
| SCHEMBL15401427 | 0.80 | GSK3A (0.39) | — | |
| SCHEMBL15400659 | 0.80 | GSK3A (0.39) | — |
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 |