Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | GUSB | P08236 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 6/20 | 0.35 |
| ▸ | RIPK2 | O43353 | 5/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 5/20 | 0.35 |
| ▸ | NMT1 | P30419 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | MERTK | Q12866 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309487 | 1.00 | LTA4H (0.38) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL26811476 | 0.90 | LTA4H (0.41) | LTA4HHTR6ACVR1RIPK2NOD2 | |
| SCHEMBL26811440 | 0.88 | HTR6 (0.41) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL29566605 | 0.88 | GUSB (0.37) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL24309488 | 0.88 | GUSB (0.37) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL26811436 | 0.87 | SLC2A1 (0.39) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL29567543 | 0.86 | LCK (0.37) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL24310035 | 0.86 | LCK (0.37) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL26811450 | 0.86 | GUSB (0.36) | LTA4HHTR6GUSBACVR1RIPK2 | |
| SCHEMBL24309496 | 0.85 | NOD2 (0.36) | HTR6ACVR1RIPK2NOD2AXL |
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 |