Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | MDH1 | P40925 | 2/20 | 0.42 |
| ▸ | MDH2 | P40926 | 2/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | MLNR | O43193 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7165673 | 0.89 | HTT (0.44) | SMN1; SMN2HTTHIF1AARALDH1A1 | |
| SCHEMBL7166226 | 0.87 | MAPT (0.48) | SMN1; SMN2HTTHIF1AARALDH1A1 | |
| SCHEMBL4071969 | 0.85 | SMN1; SMN2 (0.49) | SMN1; SMN2CYP3A4HTTHIF1AAR | |
| SCHEMBL7167448 | 0.84 | HTT (0.43) | HTTHIF1AARLMNACNR1 | |
| SCHEMBL15677151 | 0.82 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP3A4HTTHIF1AAR | |
| SCHEMBL15677164 | 0.77 | AR (0.62) | SMN1; SMN2CYP3A4HTTHIF1AAR | |
| SCHEMBL2108647 | 0.77 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP3A4HTTHIF1AAR | |
| SCHEMBL2108251 | 0.77 | ALDH1A1 (0.44) | SMN1; SMN2HTTHIF1AARALDH1A1 | |
| SCHEMBL14695225 | 0.75 | AR (0.67) | SMN1; SMN2HTTHIF1AARALDH1A1 | |
| SCHEMBL14694972 | 0.75 | AR (0.67) | SMN1; SMN2HTTHIF1AARALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6566561-B1 | Phenoxy fluoro-alcohols, their preparation, and their use as phase modifiers and solvating agents | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF ENERGY | 2003-05-20 | — | — | US | disclosed |