Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 4/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5049925 | 1.00 | RECQL (0.41) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL5322587 | 1.00 | RECQL (0.41) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL6264176 | 0.81 | PTPRC (0.40) | IDO1KMT2AALDH1A1TDP1HTT | |
| SCHEMBL5907397 | 0.76 | GABRA1 (0.44) | RECQLS100A4SMN1; SMN2KMT2ACYP3A4 | |
| SCHEMBL18713606 | 0.75 | PTGDR2 (0.43) | RECQLS100A4SMN1; SMN2KMT2AALOX15 | |
| SCHEMBL30839728 | 0.74 | TSHR (0.65) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL11517368 | 0.74 | TSHR (0.65) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL30978223 | 0.74 | CYP3A4 (0.50) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL22517366 | 0.74 | CYP3A4 (0.50) | RECQLIDO1S100A4SMN1; SMN2KMT2A | |
| SCHEMBL4058252 | 0.74 | SLC6A4 (0.45) | SMN1; SMN2TSHRLMNAHPGDHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2007741-A1 | ENANTIOMERICALLY PURE S-ETIFOXINE, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS OF THEIR USE | Xytis Inc. (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007109288-A2 | ENANTIOMERICALLY PURE R-ETIFOXINE, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS OF THEIR USE | XYTIS INC. (US) | 2007-09-27 | — | — | WO | disclosed |
| WO-2007109289-A1 | ENANTIOMERICALLY PURE S-ETIFOXINE, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS OF THEIR USE | XYTIS INC. (US) | 2007-09-27 | — | — | WO | disclosed |