Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 5/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 7/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309421 | 1.00 | BRD4 (0.36) | BRD4HTR1AHTR7HTR6FGFR1 | |
| SCHEMBL26809820 | 0.90 | BRD4 (0.39) | BRD4HTR1AHTR7HTR6TNK2 | |
| SCHEMBL29566472 | 0.90 | BRD4 (0.39) | BRD4HTR1AHTR7HTR6TNK2 | |
| SCHEMBL29567125 | 0.88 | HTR6 (0.37) | BRD4HTR1AHTR7HTR6TNK2 | |
| SCHEMBL26809792 | 0.88 | HTR6 (0.37) | BRD4HTR1AHTR7HTR6TNK2 | |
| SCHEMBL29567270 | 0.87 | BRD4 (0.38) | BRD4HTR1AHTR7HTR6FGFR1 | |
| SCHEMBL24309420 | 0.87 | BRD4 (0.38) | BRD4HTR1AHTR7HTR6FGFR1 | |
| SCHEMBL26808191 | 0.86 | BRD4 (0.42) | BRD4CCNA2CDK2CCNA1 | |
| SCHEMBL29567245 | 0.86 | BRD4 (0.42) | BRD4CCNA2CDK2CCNA1 | |
| SCHEMBL26809807 | 0.84 | HTR6 (0.35) | BRD4HTR1AHTR7HTR6TNK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |