Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 12/20 | 0.42 |
| ▸ | TDO2 | P48775 | 12/20 | 0.42 |
| ▸ | IDO2 | Q6ZQW0 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL4409812 | 0.84 | KCNA5 (0.44) | IDO1TDO2IDO2SLC6A2SLC6A4 | |
| SCHEMBL4409887 | 0.77 | MEN1 (0.37) | IDO1TDO2IDO2SLC6A2SLC6A4 | |
| SCHEMBL4384901 | 0.71 | IDO1 (0.43) | IDO1TDO2IDO2KCNA5CDC7 | |
| Pyrazine SCHEMBL28622202 | 0.67 | TSHR (0.50) | HTTALDH1A1HPGD | |
| Dalfampridine SCHEMBL18491229 | 0.66 | TSHR (0.56) | HTTALDH1A1CDC7HPGD | |
| SCHEMBL28781263 | 0.66 | TSHR (0.44) | HTTALDH1A1L3MBTL1HPGD | |
| SCHEMBL4078370 | 0.65 | TSHR (0.48) | HTTALDH1A1L3MBTL1HPGD | |
| SCHEMBL4410186 | 0.65 | IDO1 (0.51) | IDO1ALDH1A1L3MBTL1 | |
| SCHEMBL11604414 | 0.63 | TSHR (0.46) | HTTALDH1A1L3MBTL1HPGD | |
| Pyridine SCHEMBL28719261 | 0.63 | TSHR (0.46) | HTTALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2040698-A2 | OXIME COMPOUNDS AND THE USE THEREOF | SHIONOGI & CO., LTD. (JP) | 2009-04-01 | — | — | EP | disclosed |
| WO-2008008398-A2 | OXIME COMPOUNDS AND THE USE THEREOF | SHIONOGI & CO., LTD. (JP) | 2008-01-17 | — | — | WO | disclosed |