Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL811680 | 0.97 | POLB (0.41) | POLBCES2CES1HTTPARP1 | |
| SCHEMBL161645 | 0.93 | CES2 (0.42) | POLBCES2CES1HTTPARP1 | |
| Bromide SCHEMBL29086958 | 0.90 | CES2 (0.40) | POLBCES2CES1HTTPARP1 | |
| SCHEMBL12544632 | 0.90 | CES2 (0.40) | POLBCES2CES1HTTPARP1 | |
| SCHEMBL1703382 | 0.90 | CES2 (0.40) | POLBCES2CES1HTTPARP1 | |
| SCHEMBL9147301 | 0.87 | CES2 (0.42) | POLBCES2CES1HTTPARP1 | |
| SCHEMBL707937 | 0.85 | ESR1 (0.39) | POLBCES2CES1HTT | |
| SCHEMBL3145740 | 0.85 | POLB (0.35) | POLBCES2CES1HTT | |
| SCHEMBL11044013 | 0.83 | TAS1R3 (0.45) | POLBALDH1A1GAAMEN1KMT2A | |
| SCHEMBL811303 | 0.81 | CES2 (0.44) | POLBCES2CES1CA1CA2 |
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-109852242-A | A kind of hydrophobic oil resistant flame-retardant anti-corrosion multifunctional coating and preparation method | 北京化工大学 | 2019-06-07 | — | — | CN | disclosed |