Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.34 |
| ▸ | HTR7 | P34969 | 3/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.34 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | PCK1 | P35558 | 1/20 | 0.32 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL24309774 | 1.00 | HTR1A (0.34) | HTR1AHTR7HRH3FGFR1FGFR3 | |
| SCHEMBL26808701 | 0.92 | PDE10A (0.36) | HTR1AHTR7HRH3FGFR1FGFR3 | |
| SCHEMBL26811495 | 0.92 | PARP1 (0.34) | HTR1AHTR7HRH3FGFR1FGFR3 | |
| SCHEMBL29567325 | 0.90 | FGFR1 (0.39) | HTR1AHTR7FGFR1FGFR3AURKA | |
| SCHEMBL24309822 | 0.90 | FGFR1 (0.39) | HTR1AHTR7FGFR1FGFR3AURKA | |
| SCHEMBL29566810 | 0.86 | FGFR1 (0.40) | HTR1AHTR7FGFR1FGFR3EGFR | |
| SCHEMBL24309919 | 0.86 | FGFR1 (0.40) | HTR1AHTR7FGFR1FGFR3EGFR | |
| SCHEMBL24309861 | 0.85 | HTR1A (0.40) | HTR1AHTR7FGFR1AURKAAURKB | |
| SCHEMBL29567228 | 0.85 | HTR1A (0.40) | HTR1AHTR7FGFR1AURKAAURKB | |
| SCHEMBL24309827 | 0.82 | HTR1A (0.43) | HTR1AHTR7FGFR1EGFRKDR |
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 |