Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GUSB | P08236 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | PTPN5 | P54829 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30127784 | 0.89 | NUDT1 (0.37) | HDAC4HDAC2HDAC8NUDT1BACE1 | |
| SCHEMBL29375612 | 0.89 | NUDT1 (0.37) | HDAC4HDAC2HDAC8NUDT1BACE1 | |
| SCHEMBL757158 | 0.89 | NUDT1 (0.37) | HDAC4HDAC2HDAC8NUDT1BACE1 | |
| SCHEMBL278769 | 0.87 | NUDT1 (0.40) | NUDT1BACE1HSP90AA1CYP1A2KDM4E | |
| SCHEMBL30899216 | 0.81 | NUDT1 (0.37) | NUDT1BACE1HSP90AA1CYP1A2MAPT | |
| SCHEMBL278752 | 0.81 | NUDT1 (0.37) | NUDT1BACE1HSP90AA1 | |
| SCHEMBL757144 | 0.81 | SLC6A4 (0.40) | NUDT1BACE1HSP90AA1 | |
| SCHEMBL30374841 | 0.81 | SLC6A4 (0.40) | NUDT1BACE1HSP90AA1 | |
| SCHEMBL29373431 | 0.81 | SLC6A4 (0.40) | NUDT1BACE1HSP90AA1 | |
| SCHEMBL15703018 | 0.81 | NUDT1 (0.32) | NUDT1BACE1HSP90AA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6001741-A | — | — | None | — | — | JP | disclosed |
| JP-H061741-A | NOVEL POLYPHENOL AND PRODUCTION OF ITS HIGHLY PURE PRODUCT | HONSYU KAGAKU KOGYO KK | 1994-01-11 | — | — | JP | disclosed |