Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| Water SCHEMBL7941486 | 0.85 | SLC22A1 (0.33) | SLC22A1TSHR | |
| SCHEMBL13714491 | 0.81 | SLC22A1 (0.45) | SLC22A1TSHR | |
| Water SCHEMBL27980142 | 0.75 | — | — | |
| SCHEMBL15969554 | 0.72 | TSHR (0.31) | TSHR | |
| SCHEMBL27779468 | 0.71 | SLC22A1 (0.37) | SLC22A1TSHR | |
| Bromide SCHEMBL29773378 | 0.69 | SLC22A1 (0.39) | SLC22A1TSHR | |
| SCHEMBL1832101 | 0.69 | SLC22A1 (0.41) | SLC22A1TSHR | |
| SCHEMBL15611974 | 0.69 | TSHR (0.42) | SLC22A1TSHR | |
| Water SCHEMBL2161195 | 0.68 | TSHR (0.38) | SLC22A1TSHR | |
| Hydrochloric Acid SCHEMBL5174556 | 0.67 | TSHR (0.40) | SLC22A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4162269-A | BISULFITE ADDITION USING QUATERNARY AMMONIUM SALT, TERTIARY AMINE SALT, OR MACROCYCLIC POLYETHER AS CATALYST; DECOMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1979-07-24 | — | — | US | disclosed |