Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 16/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 16/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL28941849 | 0.89 | CYP2D6 (0.75) | CYP3A4CYP2D6 | |
| SCHEMBL28941842 | 0.88 | CYP3A4 (0.59) | CYP3A4CYP2D6 | |
| SCHEMBL23014811 | 0.86 | CYP3A4 (0.94) | CYP3A4CYP2D6 | |
| SCHEMBL23014812 | 0.86 | CYP3A4 (0.94) | CYP3A4CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL29829008 | 0.86 | CYP3A4 (0.94) | CYP3A4CYP2D6 | |
| SCHEMBL28753422 | 0.85 | CYP3A4 (0.60) | CYP3A4CYP2D6 | |
| SCHEMBL28753408 | 0.84 | CYP2D6 (0.60) | CYP3A4CYP2D6 | |
| SCHEMBL23015006 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP2D6 | |
| SCHEMBL23015010 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP2D6 | |
| SCHEMBL28753393 | 0.83 | CYP3A4 (0.72) | CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114502172-A | Nucleoside prodrugs and related uses thereof | 爱默蕾大学 | 2022-05-13 | — | — | CN | disclosed |