Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | HTR7 | P34969 | 4/20 | 0.33 |
| ▸ | LSS | P48449 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.31 |
| ▸ | EDNRA | P25101 | 3/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.31 |
| ▸ | PCK1 | P35558 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310165 | 1.00 | GHSR (0.34) | GHSRDRD2DRD1DRD4DRD5 | |
| SCHEMBL24310782 | 0.93 | DRD2 (0.37) | GHSRDRD2DRD1DRD4DRD5 | |
| SCHEMBL29566839 | 0.93 | DRD2 (0.37) | GHSRDRD2DRD1DRD4DRD5 | |
| SCHEMBL24309541 | 0.92 | HTR1A (0.34) | DRD2PTK2HTR1AHTR7PCK1 | |
| SCHEMBL24310103 | 0.87 | HTR1A (0.33) | PTK2HTR1AHTR7TNK2 | |
| SCHEMBL29566882 | 0.87 | HTR1A (0.33) | PTK2HTR1AHTR7TNK2 | |
| SCHEMBL24309772 | 0.86 | HTR1A (0.35) | DRD2PTK2HTR1AHTR7CCND1 | |
| SCHEMBL29567305 | 0.85 | BRD4 (0.35) | DRD2PTK2HTR1AHTR7PCK1 | |
| SCHEMBL26812416 | 0.85 | BRD4 (0.35) | DRD2PTK2HTR1AHTR7PCK1 | |
| SCHEMBL24310187 | 0.85 | RAD52 (0.36) | DRD3HTR1AHTR7 |
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 |