Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL4072779 | 0.86 | CHRM3 (0.36) | CHRM3CYP2C19GRM5 | |
| SCHEMBL10618108 | 0.84 | CYP2C19 (0.43) | CYP2C19 | |
| SCHEMBL26370289 | 0.76 | CYP19A1 (0.33) | CHRM3CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL25392963 | 0.74 | — | — | |
| SCHEMBL24325931 | 0.71 | CYP19A1 (0.31) | CHRM3ALDH1A1L3MBTL1 | |
| SCHEMBL4024953 | 0.71 | CTSC (0.34) | — | |
| Cyclohexane SCHEMBL7797729 | 0.71 | EPHX1 (0.43) | CYP2C19L3MBTL1 | |
| SCHEMBL25380201 | 0.70 | APLNR (0.33) | — | |
| SCHEMBL25382273 | 0.70 | APLNR (0.48) | CYP2C19ALDH1A1 | |
| SCHEMBL22160003 | 0.70 | CYP2C19 (0.67) | CYP2C19GRM5ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4121437-A1 | PRODRUGS OF 4'-C-SUBSTITUTED-2-HALO-2'-DEOXYADENOSINE NUCLEOSIDES AND METHODS OF MAKING AND USING THE SAME | GILEAD SCIENCES, INC. (US) | 2023-01-25 | — | — | EP | disclosed |