Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL19506043 | 0.77 | USP2 (0.54) | USP2TSHRCA1CA2 | |
| SCHEMBL9980980 | 0.73 | USP2 (0.37) | USP2TSHRCA1CA2ALDH1A1 | |
| Fluoride SCHEMBL779013 | 0.71 | USP2 (0.35) | USP2TSHRCA1CA2ALDH1A1 | |
| SCHEMBL778396 | 0.67 | TDP1 (0.31) | TSHRALDH1A1 | |
| SCHEMBL777164 | 0.65 | — | — | |
| Fluoride SCHEMBL776325 | 0.65 | — | — | |
| SCHEMBL15742682 | 0.65 | — | — | |
| SCHEMBL2672562 | 0.65 | — | — | |
| Lithium Ion SCHEMBL17456601 | 0.63 | — | — | |
| SCHEMBL16150189 | 0.63 | — | — |
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-114163369-A | Preparation method of sulfur/oxygen ester group-containing aromatic hydrocarbon compound | 武汉工程大学 | 2022-03-11 | — | — | CN | disclosed |