Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SKP2 | Q13309 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | S100B | P04271 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10805069 | 0.93 | SKP2 (0.45) | SKP2CYP3A4ALDH1A1TDP1TSHR | |
| SCHEMBL30354422 | 0.83 | SKP2 (0.40) | SKP2CYP3A4ALDH1A1TDP1TSHR | |
| SCHEMBL1950515 | 0.83 | SKP2 (0.40) | SKP2CYP3A4ALDH1A1TDP1TSHR | |
| SCHEMBL28028910 | 0.82 | TDP1 (0.37) | CYP3A4ALDH1A1TDP1TSHRGAA | |
| SCHEMBL7439150 | 0.81 | SLC6A4 (0.39) | CYP3A4GAASLC6A4KDM4EMAPT | |
| SCHEMBL10620693 | 0.79 | KDM4E (0.39) | SKP2CYP3A4ALDH1A1TDP1TSHR | |
| SCHEMBL9910784 | 0.78 | ALDH1A1 (0.40) | SKP2ALDH1A1SLC6A4MAPTSLC6A2 | |
| SCHEMBL12986181 | 0.78 | ALDH1A1 (0.42) | CYP3A4ALDH1A1TDP1TSHRKDM4E | |
| SCHEMBL12276365 | 0.77 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL9912444 | 0.77 | PROKR1 (0.42) | ALDH1A1 |
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-106660982-A | Histone demethylase inhibitors | 赛尔基因昆蒂赛尔研究公司 | 2017-05-10 | — | — | CN | disclosed |