Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 8/20 | 0.34 |
| ▸ | HTR1A | P08908 | 5/20 | 0.33 |
| ▸ | HTR7 | P34969 | 5/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 2/20 | 0.32 |
| ▸ | JAK2 | O60674 | 3/20 | 0.32 |
| ▸ | JAK3 | P52333 | 3/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.32 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310411 | 1.00 | PTK2 (0.34) | PTK2HTR1AHTR7KCNH2DRD2 | |
| SCHEMBL29568105 | 0.93 | PTK2 (0.34) | PTK2HTR1AHTR7DRD2HTR6 | |
| SCHEMBL24309837 | 0.93 | PTK2 (0.34) | PTK2HTR1AHTR7DRD2HTR6 | |
| SCHEMBL26808560 | 0.92 | PTK2 (0.34) | PTK2HTR1AHTR7FLT4KDR | |
| SCHEMBL26808620 | 0.91 | PTK2 (0.35) | PTK2HTR1AHTR7FLT4KDR | |
| SCHEMBL24309960 | 0.91 | PTK2 (0.32) | PTK2HTR1AHTR7KCNH2DRD2 | |
| SCHEMBL24310415 | 0.90 | HTR1A (0.39) | PTK2HTR1AHTR7DRD2HTR6 | |
| SCHEMBL29566359 | 0.90 | HTR1A (0.39) | PTK2HTR1AHTR7DRD2HTR6 | |
| SCHEMBL26808552 | 0.90 | PTK2 (0.33) | PTK2HTR1AHTR7FLT4KDR | |
| SCHEMBL29566951 | 0.90 | HTR1A (0.34) | PTK2HTR1AHTR7KCNH2DRD2 |
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 |