Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 4/20 | 0.34 |
| ▸ | MAOB | P27338 | 4/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13963146 | 0.91 | PTPN1 (0.59) | GSK3BPTPN1MAOAMAOB | |
| SCHEMBL12318444 | 0.82 | PTPN1 (0.54) | PTPN1 | |
| SCHEMBL2297994 | 0.82 | GSK3B (0.54) | GSK3BMAOAMAOB | |
| SCHEMBL991358 | 0.80 | GSK3B (0.56) | GSK3BMAOAMAOB | |
| SCHEMBL2175225 | 0.80 | PTPN1 (0.56) | PTPN1MAOAMAOB | |
| SCHEMBL250821 | 0.79 | PTPN1 (0.52) | GSK3BPTPN1MAOAMAOB | |
| SCHEMBL20716158 | 0.77 | ALDH1A1 (0.48) | GSK3B | |
| SCHEMBL2172789 | 0.75 | NAPRT (0.41) | — | |
| SCHEMBL3125296 | 0.75 | GSK3B (0.31) | GSK3BMAOAMAOB | |
| SCHEMBL12479288 | 0.75 | PLK1 (0.42) | GSK3B |
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-3321263-A2 | COMPOUNDS FOR PREPARING HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Holdings Ireland (CH) | 2018-05-16 | — | — | EP | disclosed |