Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1471645 | 0.84 | ACHE (0.37) | TSHRACHEALDH1A1 | |
| SCHEMBL17066375 | 0.79 | ALDH1A1 (0.46) | TSHRALDH1A1 | |
| SCHEMBL11803189 | 0.78 | TSHR (0.41) | TSHRACHEALDH1A1 | |
| SCHEMBL28990190 | 0.76 | ACHE (0.41) | TSHRACHEALDH1A1 | |
| SCHEMBL28009539 | 0.76 | TSHR (0.35) | TSHRACHEALDH1A1 | |
| SCHEMBL9405813 | 0.74 | — | — | |
| SCHEMBL20483731 | 0.74 | LMNA (0.40) | ACHE | |
| SCHEMBL28990192 | 0.73 | ACHE (0.38) | TSHRACHEALDH1A1 | |
| Acetone SCHEMBL6036862 | 0.71 | MME (0.39) | TSHRALDH1A1 | |
| SCHEMBL863285 | 0.70 | — | — |
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-110799268-A | Method for indirectly adding organic compounds to porous solids | IFP 新能源公司 | 2020-02-14 | — | — | CN | disclosed |