Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | USP1 | O94782 | 1/20 | 0.31 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310296 | 0.89 | SOS1 (0.35) | CDK2CDK9USP1WDR48 | |
| SCHEMBL24309262 | 0.88 | CDK2 (0.32) | CDK2CDK9USP1WDR48 | |
| SCHEMBL24309736 | 0.87 | CDK2 (0.32) | CDK2CDK9USP1WDR48 | |
| SCHEMBL26806685 | 0.85 | HTR1A (0.34) | CDK2CDK9USP1WDR48 | |
| SCHEMBL29567147 | 0.85 | HTR1A (0.34) | CDK2CDK9USP1WDR48 | |
| SCHEMBL29567015 | 0.85 | HTR1A (0.34) | CDK2CDK9USP1WDR48 | |
| SCHEMBL24310457 | 0.82 | BRD4 (0.39) | CDK9EGFR | |
| SCHEMBL24309467 | 0.80 | EGFR (0.37) | CDK9EGFR | |
| SCHEMBL24309593 | 0.80 | KDM4E (0.33) | CDK9EGFR | |
| SCHEMBL24310447 | 0.79 | USP1 (0.33) | USP1WDR48 |
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-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |