Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.39 |
| ▸ | CHRNG | P07510 | 1/20 | 0.39 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CHRND | Q07001 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL121397 | 0.82 | EGFR (0.41) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL10852241 | 0.80 | SLC6A2 (0.41) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL7879929 | 0.79 | GRIN1 (0.40) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL3395753 | 0.78 | GRIN1 (0.41) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL4689099 | 0.73 | HSD11B1 (0.42) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL4689021 | 0.70 | GRIN1 (0.40) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL11239184 | 0.69 | CHRNA1 (0.35) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL991292 | 0.69 | SLC6A3 (0.47) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL11243351 | 0.68 | CHRNA1 (0.35) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL12132777 | 0.67 | MAOB (0.34) | EGFRMAOBMAOA |
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-113234066-A | Propiconazole-like compound and preparation method and application thereof | 浙江工业大学 | 2021-08-10 | — | — | CN | disclosed |