Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL2010 | 0.94 | — | — | |
| SCHEMBL8331055 | 0.71 | ACHE (0.34) | ACHEALDH1A1 | |
| SCHEMBL8658839 | 0.69 | — | — | |
| SCHEMBL6178734 | 0.67 | TRPM8 (0.39) | TSHR | |
| SCHEMBL6177020 | 0.66 | — | — | |
| SCHEMBL8331995 | 0.65 | — | — | |
| SCHEMBL8330604 | 0.63 | TRPM8 (0.34) | — | |
| Butane SCHEMBL120287 | 0.63 | ACHE (0.37) | ACHETSHRALDH1A1 | |
| Butane SCHEMBL6817226 | 0.61 | FDPS (0.38) | ACHE | |
| SCHEMBL1729012 | 0.60 | — | — |
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-105683167-B | Salt of nitrogen-containing heterocyclic compound or crystal thereof, pharmaceutical composition, and F L T3 inhibitor | 富士胶片株式会社 | 2018-10-23 | — | — | CN | disclosed |