Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 5/20 | 0.41 |
| ▸ | HTR1A | P08908 | 5/20 | 0.41 |
| ▸ | HTR7 | P34969 | 5/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | RIPK2 | O43353 | 3/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.38 |
| ▸ | NOD2 | Q9HC29 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | GUSB | P08236 | 2/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309746 | 1.00 | HTR6 (0.41) | HTR6HTR1AHTR7DRD2RIPK2 | |
| SCHEMBL26807773 | 0.88 | RIPK2 (0.43) | HTR6HTR7RIPK2ACVR1NOD2 | |
| SCHEMBL26807780 | 0.88 | LTA4H (0.47) | HTR6RIPK2ACVR1NOD2FLT3 | |
| SCHEMBL26807751 | 0.87 | GUSB (0.41) | HTR6HTR1ARIPK2ACVR1NOD2 | |
| SCHEMBL24309732 | 0.85 | LTA4H (0.35) | RIPK2ACVR1NOD2FLT3GUSB | |
| SCHEMBL26808355 | 0.85 | HTR6 (0.39) | HTR6HTR1AHTR7DRD2RIPK2 | |
| SCHEMBL26807788 | 0.85 | MAPK10 (0.47) | HTR6HTR1ARIPK2ACVR1NOD2 | |
| SCHEMBL26807778 | 0.84 | HTR3E (0.46) | HTR6HTR1AHTR7RIPK2ACVR1 | |
| SCHEMBL29566834 | 0.84 | HTR6 (0.38) | HTR6HTR1AHTR7DRD2RIPK2 | |
| SCHEMBL26807343 | 0.84 | HTR6 (0.38) | HTR6HTR1AHTR7DRD2RIPK2 |
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 |