Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28246688 | 0.77 | — | — | |
| SCHEMBL11757030 | 0.73 | TSHR (0.33) | TSHR | |
| SCHEMBL15986792 | 0.73 | ALDH1A1 (0.31) | ALDH1A1CYP3A4TSHR | |
| Acrylic Acid Methyl Ester SCHEMBL29199106 | 0.70 | KEAP1 (0.31) | — | |
| Methacrylic Acid SCHEMBL9546433 | 0.70 | ALDH1A1 (0.31) | ALDH1A1 | |
| Acrylic Acid SCHEMBL2526672 | 0.64 | LMNA (0.40) | — | |
| SCHEMBL5014838 | 0.64 | TSHR (0.50) | ALDH1A1CYP3A4TSHR | |
| Acrylamide SCHEMBL15013316 | 0.63 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL27811830 | 0.63 | — | — | |
| SCHEMBL27125072 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993023773-A1 | PROCESS FOR PREPARATION OF OXYGEN PERMEABLE POLYMER MATERIAL | CIBA-GEIGY AG (CH) | 1993-11-25 | — | — | WO | disclosed |