Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | POLQ | O75417 | 5/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.34 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL545297 | 0.86 | NR1H2 (0.46) | NR1H2S1PR1GLAPOLBGAA | |
| SCHEMBL31162543 | 0.77 | NR1H2 (0.49) | NR1H2GLAPOLBGAATSHR | |
| SCHEMBL5423901 | 0.75 | NR1H2 (0.48) | NR1H2GLAPOLBGAATSHR | |
| SCHEMBL28382816 | 0.75 | NR1H2 (0.47) | NR1H2S1PR1GLAPOLBGAA | |
| SCHEMBL28851099 | 0.75 | NR1H2 (0.47) | NR1H2S1PR1GLAPOLBGAA | |
| SCHEMBL1845384 | 0.74 | MEN1 (0.46) | EPHX2MEN1KMT2AHTTL3MBTL1 | |
| SCHEMBL4678727 | 0.73 | EPHX2 (0.48) | NR1H2GLAPOLBGAATSHR | |
| SCHEMBL1205533 | 0.72 | MAOA (0.49) | TSHRMEN1KMT2AHTTL3MBTL1 | |
| SCHEMBL1438626 | 0.72 | RIPK1 (0.41) | TSHREPHX2MEN1KMT2AHTT | |
| SCHEMBL5423903 | 0.72 | POLB (0.42) | NR1H2S1PR1GLAPOLBGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8110687-B2 | Bicyclic compounds with kinase inhibitory activity | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-07 | — | — | US | disclosed |