Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.44 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL547986 | 0.82 | SLC6A2 (0.47) | IDO1AGXTMEN1KMT2ATACR1 | |
| SCHEMBL28534097 | 0.81 | CHRNB2 (0.45) | IDO1AGXTMEN1KMT2ATACR1 | |
| SCHEMBL6205189 | 0.81 | CNR2 (0.48) | IDO1TDO2CNR2SLC6A9SLC6A5 | |
| SCHEMBL6205190 | 0.81 | CNR2 (0.48) | IDO1TDO2CNR2SLC6A9SLC6A5 | |
| SCHEMBL6035746 | 0.78 | IDO1 (0.43) | IDO1TDO2CNR2SLC6A9SLC6A5 | |
| SCHEMBL27502909 | 0.75 | ALOX5 (0.50) | KMT2APPARGPPARASLC6A2SLC6A4 | |
| SCHEMBL6181884 | 0.73 | CHRNB2 (0.63) | IDO1TDO2AGXTMEN1KMT2A | |
| SCHEMBL22785928 | 0.72 | CA1 (0.47) | IDO1TDO2CNR2SLC6A9SLC6A5 | |
| SCHEMBL7817242 | 0.72 | MAOB (0.54) | KMT2A | |
| SCHEMBL28528002 | 0.71 | CHRNB2 (0.45) | AGXTMEN1KMT2ATACR1SLC6A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1910363-A2 | HIV INTEGRASE INHIBITORS | SmithKline Beecham Corporation (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007019098-A2 | HIV INTEGRASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-02-15 | — | — | WO | disclosed |
| EP-1720856-A2 | HIV INTEGRASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-11-15 | — | — | EP | disclosed |
| WO-2005077050-A2 | HIV INTEGRASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-08-25 | — | — | WO | disclosed |