Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | PHGDH | O43175 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1114336 | 0.87 | KDM4E (0.39) | ALDH1A1KDM4EATMHTTKMT2A | |
| SCHEMBL1114610 | 0.67 | ALDH1A1 (0.34) | ALDH1A1KDM4EATMTSHRKMT2A | |
| SCHEMBL30482351 | 0.64 | KDM4E (0.38) | ALDH1A1KDM4EATMHTTTSHR | |
| SCHEMBL1114927 | 0.63 | KMT2A (0.49) | KDM4EKMT2AMEN1MAPTEPHX2 | |
| SCHEMBL30482302 | 0.62 | KDM4E (0.36) | ALDH1A1KDM4EATMKMT2AMEN1 | |
| SCHEMBL15055647 | 0.61 | KMT2A (0.47) | ALDH1A1KDM4EATMTSHRKMT2A | |
| SCHEMBL20818003 | 0.58 | MKNK1 (0.46) | ALDH1A1KDM4EATMKMT2AMEN1 | |
| SCHEMBL20817931 | 0.58 | TDP1 (0.44) | ALDH1A1KDM4EATMKMT2ACOMT | |
| SCHEMBL27858676 | 0.58 | COMT (0.46) | ALDH1A1KDM4EATMTSHRKMT2A | |
| SCHEMBL31669175 | 0.57 | ALDH1A1 (0.74) | ALDH1A1KDM4EATMTSHRKMT2A |
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-2278879-A2 | COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES | Institute for OneWorld Health (US) | 2011-02-02 | — | — | EP | claimed |
| WO-2009131957-A2 | COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES | INSTITUTE FOR ONEWORLD HEALTH (US) | 2009-10-29 | — | — | WO | claimed |