Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | PKM | P14618 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11746636 | 0.93 | EPHX2 (0.58) | ALDH1A1TSHREPHX2HDAC3HDAC4 | |
| SCHEMBL17537940 | 0.85 | EPHX2 (0.58) | ALDH1A1TSHREPHX2SMN1; SMN2HDAC3 | |
| SCHEMBL2556514 | 0.79 | ALDH1A1 (0.62) | ALDH1A1TSHRSMN1; SMN2MAPTPKM | |
| SCHEMBL31353027 | 0.79 | ALDH1A1 (0.68) | ALDH1A1TSHREPHX2SMN1; SMN2MAPT | |
| SCHEMBL31353026 | 0.79 | ALDH1A1 (0.68) | ALDH1A1TSHREPHX2SMN1; SMN2MAPT | |
| SCHEMBL17537928 | 0.79 | EPHX2 (0.66) | ALDH1A1TSHREPHX2SMN1; SMN2HDAC3 | |
| SCHEMBL17537936 | 0.78 | EPHX2 (0.53) | ALDH1A1TSHREPHX2SMN1; SMN2HDAC3 | |
| SCHEMBL10921009 | 0.78 | ALDH1A1 (0.66) | ALDH1A1TSHREPHX2SMN1; SMN2MAPT | |
| SCHEMBL19258601 | 0.77 | EPHX2 (0.69) | ALDH1A1TSHREPHX2SMN1; SMN2HDAC3 | |
| SCHEMBL17537910 | 0.77 | EPHX2 (0.69) | ALDH1A1TSHREPHX2SMN1; SMN2HDAC3 |
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-2016022943-A2 | NOVEL MONOMERS FROM BIOMASS | NDSU RESEARCH FOUNDATION (US) | 2016-02-11 | — | — | WO | disclosed |