Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL9719892 | 0.79 | — | — | |
| SCHEMBL326094 | 0.75 | — | — | |
| Tert-Butanol SCHEMBL27700314 | 0.73 | — | — | |
| Tert-Butanol SCHEMBL8091978 | 0.73 | TSHR (0.37) | TSHRALOX15ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL754852 | 0.71 | — | — | |
| SCHEMBL9312342 | 0.71 | — | — | |
| Fluoride SCHEMBL7573266 | 0.71 | — | — | |
| Water SCHEMBL5382704 | 0.71 | — | — | |
| SCHEMBL27533867 | 0.69 | — | — | |
| Tert-Butanol SCHEMBL7720036 | 0.68 | — | — |
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-6376715-B1 | FROM AN ORGANOMETALLIC COMPOUND | INEOS ACRYLICS U.K. LIMITED (GB) | 2002-04-23 | — | — | US | disclosed |