Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11528810 | 0.88 | L3MBTL1 (0.36) | CYP2C19HTT | |
| SCHEMBL22326440 | 0.69 | FAAH (0.39) | HTT | |
| SCHEMBL11795197 | 0.68 | APEX1 (0.41) | — | |
| SCHEMBL22326441 | 0.67 | FAAH (0.38) | HTT | |
| SCHEMBL11530342 | 0.66 | L3MBTL1 (0.36) | — | |
| SCHEMBL14593602 | 0.64 | FAAH (0.42) | CYP2C19HTT | |
| SCHEMBL20091605 | 0.64 | TSHR (0.48) | GAAHTT | |
| SCHEMBL11117555 | 0.64 | APEX1 (0.39) | HTT | |
| SCHEMBL10927240 | 0.64 | APEX1 (0.34) | — | |
| SCHEMBL9768557 | 0.64 | ALDH1A1 (0.37) | CYP2C19HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4134770-A | VINYLSULFONYLPROPIONYL COMPOUNDS | MITSUBISHI PAPER MILLS, LTD. (JP) | 1979-01-16 | — | — | US | disclosed |