Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.40 |
| ▸ | GPR3 | P46089 | 4/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15933301 | 0.91 | SLC6A4 (0.40) | PPARGPPARDPPARAHRH4PDE2A | |
| SCHEMBL12414811 | 0.83 | PDE2A (0.48) | HRH4GPR3PDE2ACHRM5SLC6A4 | |
| SCHEMBL13137672 | 0.83 | GPR3 (0.41) | PPARGPPARDPPARAHRH4GPR3 | |
| SCHEMBL23998936 | 0.82 | TRPV1 (0.40) | PPARDPPARAHRH4GPR3SCN5A | |
| SCHEMBL14143900 | 0.81 | CHRM5 (0.43) | PPARGPPARDPPARAGPR3SCN5A | |
| SCHEMBL5018773 | 0.81 | APLNR (0.42) | — | |
| SCHEMBL17449711 | 0.80 | PDE2A (0.44) | HRH4GPR3PDE2ASLC6A4FFAR4 | |
| SCHEMBL13568401 | 0.79 | GPR3 (0.41) | PPARGPPARDPPARAHRH4GPR3 | |
| SCHEMBL20817904 | 0.79 | GPR3 (0.41) | PPARGPPARDPPARAHRH4GPR3 | |
| SCHEMBL966621 | 0.79 | GPR3 (0.41) | PPARGPPARDPPARAHRH4GPR3 |
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 |