Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | CCNC | P24863 | 2/20 | 0.34 |
| ▸ | CDK8 | P49336 | 2/20 | 0.34 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | WNT1 | P04628 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | CLK3 | P49761 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.33 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 3/20 | 0.32 |
| ▸ | LIPE | Q05469 | 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 | |
|---|---|---|---|---|
| SCHEMBL24309811 | 0.85 | HRH3 (0.40) | HRH3HRH1TTKWNT1CLK2 | |
| SCHEMBL24309639 | 0.81 | HRH3 (0.41) | HRH3SCN9AHRH1CCNCCDK8 | |
| SCHEMBL29566701 | 0.81 | HRH3 (0.41) | HRH3SCN9AHRH1CCNCCDK8 | |
| SCHEMBL24310300 | 0.81 | HRH3 (0.35) | HRH3HRH1TTKWNT1CLK2 | |
| SCHEMBL24309787 | 0.81 | MAPT (0.36) | CDK19MAPT | |
| SCHEMBL24310524 | 0.77 | BRD4 (0.37) | CCNCCDK8TTK | |
| SCHEMBL24309743 | 0.76 | LTA4H (0.41) | — | |
| SCHEMBL24310792 | 0.74 | F2 (0.38) | SCN9AFGFR1FGFR3GRM5AURKA | |
| SCHEMBL24310796 | 0.72 | F10 (0.43) | CCNCCDK8FGFR1FGFR3 | |
| SCHEMBL26807622 | 0.70 | HRH3 (0.43) | HRH3SCN9AHRH1TTKPARP1 |
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 |