Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL6818612 | 0.79 | TRPA1 (0.35) | TRPA1 | |
| SCHEMBL10206109 | 0.76 | BCL2L1 (0.39) | PNMT | |
| SCHEMBL20825133 | 0.76 | ALDH1A1 (0.42) | — | |
| SCHEMBL28228041 | 0.76 | ACHE (0.37) | PNMT | |
| SCHEMBL18007622 | 0.73 | CA2 (0.41) | PNMT | |
| SCHEMBL12961127 | 0.72 | GABRA1 (0.36) | — | |
| SCHEMBL31061252 | 0.72 | HTR5A (0.41) | PNMT | |
| SCHEMBL21696800 | 0.72 | PNMT (0.39) | PNMT | |
| SCHEMBL30872001 | 0.72 | ALDH1A1 (0.49) | PNMT | |
| SCHEMBL29216432 | 0.72 | ALDH1A1 (0.49) | PNMT |
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-3052107-B1 | ORGANIC COMPOUNDS TO TREAT HEPATITIS B VIRUS | NOVARTIS AG (CH) | 2018-05-02 | — | — | EP | disclosed |