Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 11/20 | 0.47 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17782865 | 0.98 | AR (0.49) | ARTRPV4KIF11TAS2R14CYP11B1 | |
| SCHEMBL29224606 | 0.96 | AR (0.47) | ARTRPV4KIF11TAS2R14CYP11B1 | |
| SCHEMBL3480548 | 0.83 | KIF11 (0.56) | ARKIF11CYP11B1CYP11B2 | |
| SCHEMBL29546917 | 0.81 | AR (0.52) | ARKIF11TAS2R14CYP11B1CYP11B2 | |
| SCHEMBL12151755 | 0.81 | AR (0.52) | ARKIF11TAS2R14CYP11B1CYP11B2 | |
| SCHEMBL964361 | 0.78 | AR (0.49) | ARKIF11TAS2R14 | |
| SCHEMBL1996075 | 0.78 | AR (0.73) | AR | |
| SCHEMBL495426 | 0.78 | CYP11B1 (0.57) | ARTRPV4KIF11TAS2R14CYP11B1 | |
| SCHEMBL16952881 | 0.76 | AR (0.47) | ARKIF11TAS2R14CYP11B1CYP11B2 | |
| SCHEMBL669827 | 0.76 | AR (0.47) | ARKIF11TAS2R14CYP11B1CYP11B2 |
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-118146127-A | Preparation method of 2-methylthio-4-trifluoromethyl benzonitrile | 北京颖泰嘉和生物科技股份有限公司 | 2024-06-07 | — | — | CN | disclosed |