Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.39 |
| ▸ | CLCN2 | P51788 | 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 | |
|---|---|---|---|---|
| SCHEMBL22624872 | 0.70 | CYP3A4 (0.33) | — | |
| SCHEMBL11667899 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL1363486 | 0.68 | GABRA1 (0.50) | GABRA1GABRB2 | |
| SCHEMBL18499741 | 0.66 | ALDH1A1 (0.38) | — | |
| SCHEMBL10077289 | 0.65 | CD44 (0.30) | — | |
| Propene SCHEMBL27662890 | 0.65 | GABRA1 (0.46) | GABRA1GABRB2 | |
| SCHEMBL6285101 | 0.63 | GABRA1 (0.44) | GABRA1GABRB2 | |
| SCHEMBL12802109 | 0.63 | GABRA1 (0.45) | GABRA1GABRB2 | |
| SCHEMBL198837 | 0.62 | GABRA1 (0.55) | GABRA1GABRB2CLCN2 | |
| SCHEMBL8346103 | 0.61 | CD44 (0.30) | — |
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-3943500-A1 | PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF | Agilent Technologies, Inc. (US) | 2022-01-26 | — | — | EP | disclosed |