Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | AGXT | P21549 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL776935 | 0.79 | TSHR (0.52) | TSHREPHX2IDO1AGXTALDH1A1 | |
| SCHEMBL28652165 | 0.78 | TSHR (0.43) | TSHREPHX2IDO1AGXTALDH1A1 | |
| SCHEMBL776867 | 0.75 | NR4A2 (0.43) | EPHX2IDO1AGXTKMT2ALMNA | |
| SCHEMBL779903 | 0.72 | CA12 (0.35) | ALDH1A1CA1CA2CA9GAA | |
| SCHEMBL4344980 | 0.72 | TSHR (0.44) | TSHREPHX2IDO1AGXTALDH1A1 | |
| SCHEMBL10692407 | 0.72 | TSHR (0.44) | TSHREPHX2IDO1AGXTALDH1A1 | |
| SCHEMBL779894 | 0.71 | NR4A2 (0.49) | IDO1AGXT | |
| SCHEMBL4342737 | 0.71 | TSHR (0.43) | TSHREPHX2IDO1AGXTALDH1A1 | |
| SCHEMBL778273 | 0.70 | CA1 (0.32) | CA1CA2CA9 | |
| SCHEMBL7698932 | 0.68 | TSHR (0.41) | TSHREPHX2IDO1AGXTALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7794876-B2 | Pentafluorophenyloxy compound, and nonaqueous electrolyte solution and lithium secondary battery using same | UBE INDUSTRIES, LTD. (JP) | 2010-09-14 | — | — | US | disclosed |
| US-20080107969-A1 | Pentafluorophenyl Methyl Oxalate; good electrical, cycling and storage properties; reacting pentafluorophenol with ethyl chloroglyoxylate | UBE INDUSTRIES, LTD. (JP) | 2008-05-08 | — | — | US | disclosed |