Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 7/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26028368 | 0.83 | POLB (0.41) | BCHEDRD4CHRM2SCN8A | |
| SCHEMBL22957720 | 0.82 | BCHE (0.49) | BCHEMEN1KMT2AHDAC4MEF2D | |
| SCHEMBL26028493 | 0.79 | SCN8A (0.53) | MEN1KMT2AADRA1ADRD3HTR2A | |
| SCHEMBL13074511 | 0.79 | BCHE (0.49) | BCHEMEN1KMT2AHDAC4MEF2D | |
| SCHEMBL12228162 | 0.78 | BCHE (0.54) | BCHEMEN1KMT2ADRD2CHRM2 | |
| SCHEMBL5947203 | 0.78 | KDM4E (0.66) | BCHEMEN1KMT2ADRD2HTR1A | |
| SCHEMBL5947542 | 0.77 | BCHE (0.60) | BCHEMEN1KMT2ADRD2CHRM2 | |
| SCHEMBL5947539 | 0.77 | BCHE (0.56) | BCHEMEN1KMT2ADRD2HTR1A | |
| SCHEMBL5947775 | 0.76 | BCHE (0.62) | BCHEMEN1KMT2ADRD2HTR1A | |
| SCHEMBL8292121 | 0.76 | MRGPRX4 (0.48) | BCHEHDAC4MEF2DCHRM2HTR7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023154291-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |