Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.37 |
| ▸ | HTR1A | P08908 | 4/20 | 0.37 |
| ▸ | HTR7 | P34969 | 4/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | RIPK2 | O43353 | 6/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 6/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 6/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL26811346 | 1.00 | HTR6 (0.37) | HTR6HTR1AHTR7DRD2EGFR | |
| SCHEMBL24310067 | 0.90 | HTR6 (0.37) | HTR6HTR1AHTR7EGFRRIPK2 | |
| SCHEMBL29567089 | 0.90 | HTR6 (0.37) | HTR6HTR1AHTR7EGFRRIPK2 | |
| SCHEMBL24310022 | 0.90 | EGFR (0.35) | HTR6HTR1AHTR7DRD2EGFR | |
| SCHEMBL29566605 | 0.90 | GUSB (0.37) | HTR6HTR7EGFRRIPK2ACVR1 | |
| SCHEMBL24309488 | 0.90 | GUSB (0.37) | HTR6HTR7EGFRRIPK2ACVR1 | |
| SCHEMBL26811440 | 0.89 | HTR6 (0.41) | HTR6HTR1AHTR7EGFRRIPK2 | |
| SCHEMBL26811460 | 0.88 | EGFR (0.39) | HTR6HTR1AHTR7DRD2EGFR | |
| SCHEMBL26811454 | 0.88 | ACVR1 (0.36) | HTR6HTR1AHTR7EGFRRIPK2 | |
| SCHEMBL24310024 | 0.88 | LCK (0.36) | HTR6EGFRRIPK2ACVR1NOD2 |
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 |