Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.31 |
| ▸ | CHRNG | P07510 | 1/20 | 0.31 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | CHRND | Q07001 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 2/20 | 0.30 |
| ▸ | CA9 | Q16790 | 2/20 | 0.30 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.30 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17080388 | 1.00 | PDK2 (0.32) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL20435101 | 1.00 | PDK2 (0.32) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL24655699 | 0.97 | PDK2 (0.31) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL20435199 | 0.94 | PDK2 (0.33) | PDK2 | |
| SCHEMBL20435200 | 0.94 | PDK2 (0.33) | PDK2 | |
| SCHEMBL17081264 | 0.94 | PDK2 (0.30) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL17081207 | 0.93 | PDK2 (0.34) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL17081188 | 0.92 | CHRNA1 (0.31) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL20435188 | 0.92 | PDK2 (0.33) | PDK2 | |
| SCHEMBL18383237 | 0.91 | CRHR1 (0.31) | PDK2CHRNA1CHRNGCHRNB1CHRNB2 |
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-110698351-B | Material for electronic devices | 默克专利有限公司 | 2023-06-09 | — | — | CN | disclosed |