Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.41 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | SPPL2B | Q8TCT7 | 1/20 | 0.38 |
| ▸ | SPPL2A | Q8TCT8 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24017106 | 1.00 | PDE2A (0.49) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL3554072 | 0.88 | PDE2A (0.51) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL15117414 | 0.86 | PDE2A (0.49) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL16563584 | 0.86 | PDE2A (0.50) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL2021163 | 0.83 | PDE2A (0.54) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL21514785 | 0.83 | PDE2A (0.46) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1727739 | 0.83 | PDE2A (0.54) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL16563163 | 0.83 | PDE2A (0.46) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1729345 | 0.83 | PDE2A (0.54) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL24017038 | 0.82 | PDE2A (0.43) | PDE2ASLC6A2SLC6A4SLC6A3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021223156-A1 | DIBORON GLYCOL ESTER, PREPARATION METHOD THEREFOR, INTERMEDIATE THEREOF, AND APPLICATION THEREOF | 中国科学院上海有机化学研究所 | 2021-11-11 | — | — | WO | disclosed |