Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 3/20 | 0.41 |
| ▸ | THRA | P10827 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3185155 | 0.86 | NUDT1 (0.52) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL4056228 | 0.86 | NUDT1 (0.52) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL29636450 | 0.86 | NUDT1 (0.52) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL30375450 | 0.86 | NUDT1 (0.52) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL28171806 | 0.86 | ESR1 (0.47) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL3270518 | 0.83 | NUDT1 (0.58) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL8772261 | 0.83 | NUDT1 (0.49) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL7774682 | 0.82 | NUDT1 (0.51) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL28171805 | 0.82 | ESR1 (0.61) | NUDT1BACE1THRBTHRAHSP90AA1 | |
| SCHEMBL27928693 | 0.82 | NUDT1 (0.48) | NUDT1BACE1THRBTHRAHSP90AA1 |
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-108017791-A | Polyphenylene ether powder and manufacture method | 旭化成株式会社 | 2018-05-11 | — | — | CN | disclosed |