Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1003622 | 0.93 | ALDH1A1 (0.35) | ALDH1A1CYP2D6 | |
| SCHEMBL18028286 | 0.75 | CETP (0.39) | — | |
| SCHEMBL21919720 | 0.75 | — | — | |
| SCHEMBL4655234 | 0.67 | TSHR (0.44) | TSHR | |
| SCHEMBL21325022 | 0.67 | GABRR1 (0.32) | CYP2D6 | |
| Ethylamine SCHEMBL19327142 | 0.65 | — | — | |
| Tert-Butylamine SCHEMBL10839353 | 0.65 | — | — | |
| SCHEMBL2627104 | 0.65 | — | — | |
| SCHEMBL6736147 | 0.65 | — | — | |
| SCHEMBL5610279 | 0.65 | — | — |
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-5637642-A | ALKYLTRIALKOXYSILANE INCORPORATED INTO VINYL CHLORIDE MONOMER; IMPROVED ADHESION | CHIRON DIAGNOSTICS CORPORATION (US) | 1997-06-10 | — | — | US | disclosed |