Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.37 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1965066 | 0.81 | CLK4 (0.60) | CLK4EGLN2NOTUM | |
| SCHEMBL1202054 | 0.77 | NOTUM (0.37) | NPY5RNOTUM | |
| SCHEMBL5539865 | 0.76 | NISCH (0.37) | SLC6A7 | |
| SCHEMBL1973038 | 0.76 | MAPK14 (0.36) | CCNB2CDK1CCNB1GSK3AGSK3B | |
| SCHEMBL435455 | 0.76 | CYP1A2 (0.38) | CYP19A1NOTUM | |
| SCHEMBL1980545 | 0.76 | ALDH1A1 (0.38) | CCNB2CDK1CCNB1GSK3AGSK3B | |
| SCHEMBL2397171 | 0.75 | MAPT (0.42) | CYP11B2NPY5RCYP19A1NOTUMKIF11 | |
| SCHEMBL28295038 | 0.74 | GRM4 (0.41) | CYP11B2 | |
| SCHEMBL3996884 | 0.74 | CYP11B2 (0.41) | CYP11B2CLK4NPY5RCYP19A1 | |
| SCHEMBL1741768 | 0.72 | CLK4 (0.62) | CYP11B2CLK4HSD11B1MMP3CCNB2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103864677-B | Thioacetic acid salt compound, compoistion and method of use | ARDEA BIOSCIENCES, INC. (US) | 2016-05-18 | — | — | CN | disclosed |
| CN-103864677-A | THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | ARDEA BIOSCIENCES INC | 2014-06-18 | — | — | CN | disclosed |
| CN-103068801-B | Thioacetate compounds, compositions, and methods of use | ARDEA BIOSCIENCES INC | 2014-05-14 | — | — | CN | disclosed |
| EP-1861411-A2 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | LABORATOIRES FOURNIER S.A. (FR) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006100413-A9 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | FOURNIER LAB SA (FR) | 2007-10-18 | — | — | WO | disclosed |
| WO-2006100413-A2 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | LABORATOIRES FOURNIER S.A. (FR) | 2006-09-28 | — | — | WO | disclosed |