Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17937788 | 0.91 | TSHR (0.42) | TSHRTDP1ALDH1A1 | |
| SCHEMBL106078 | 0.89 | ADRB2 (0.33) | TSHR | |
| SCHEMBL706031 | 0.86 | ADRB2 (0.32) | TSHR | |
| SCHEMBL706009 | 0.86 | ADRB2 (0.32) | TSHR | |
| SCHEMBL702386 | 0.86 | ADRB2 (0.32) | TSHR | |
| SCHEMBL29201546 | 0.84 | TSHR (0.38) | TSHRTDP1ALDH1A1 | |
| SCHEMBL4087424 | 0.84 | TSHR (0.32) | TSHRTDP1 | |
| SCHEMBL11278199 | 0.84 | TSHR (0.31) | TSHRTDP1 | |
| SCHEMBL3482644 | 0.84 | ADRB2 (0.31) | — | |
| SCHEMBL17937840 | 0.83 | TSHR (0.42) | TSHRTDP1ALDH1A1 |
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-117924346-A | Multi-sulfur-containing silane coupling agent and preparation method thereof | 江西宏柏新材料股份有限公司 | 2024-04-26 | — | — | CN | claimed |