Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 6/20 | 0.67 |
| ▸ | GSK3B | P49841 | 4/20 | 0.49 |
| ▸ | GSK3A | P49840 | 3/20 | 0.42 |
| ▸ | AURKA | O14965 | 2/20 | 0.42 |
| ▸ | EGFR | P00533 | 3/20 | 0.42 |
| ▸ | BTK | Q06187 | 3/20 | 0.42 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.41 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13303630 | 0.84 | PIN1 (0.72) | PIN1GSK3BGSK3AAURKAEGFR | |
| SCHEMBL19958511 | 0.82 | PIN1 (0.72) | PIN1GSK3BGSK3AAURKAEGFR | |
| SCHEMBL8298036 | 0.82 | PIN1 (0.72) | PIN1GSK3BGSK3AAURKAEGFR | |
| SCHEMBL656001 | 0.82 | PIN1 (0.72) | PIN1GSK3BGSK3AAURKABTK | |
| SCHEMBL28496081 | 0.82 | SYK (0.53) | GSK3BGSK3AAURKAEGFRBTK | |
| SCHEMBL3976795 | 0.81 | PIN1 (1.00) | PIN1GSK3BGSK3AAURKAEGFR | |
| SCHEMBL28488910 | 0.81 | JAK3 (0.47) | GSK3BGSK3AAURKAEGFRBTK | |
| SCHEMBL4520873 | 0.79 | PIN1 (0.67) | PIN1GSK3BBTKABCG2 | |
| SCHEMBL19877901 | 0.79 | PIN1 (0.71) | PIN1GSK3BGSK3AAURKAEGFR | |
| SCHEMBL28489395 | 0.79 | EGFR (0.41) | PIN1EGFRTNNI3K |
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-112110863-A | Sulfonyl fluoride compound, preparation method thereof and method for preparing sulfonamide compound through sulfonyl fluoride compound | 中山大学 | 2020-12-22 | — | — | CN | disclosed |