Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.44 |
| ▸ | F10 | P00742 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CCNC | P24863 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | CCKAR | P32238 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3629011 | 0.86 | GBA1 (0.44) | F10ALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL3634324 | 0.85 | PIK3CA (0.43) | F10ALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL3629695 | 0.82 | MAPT (0.44) | F10ALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL3635713 | 0.81 | HCRTR1 (0.51) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL3085564 | 0.81 | LMNA (0.56) | SLC6A7ALDH1A1SMN1; SMN2MAPTMEN1 | |
| SCHEMBL3627322 | 0.77 | F10 (0.39) | F10MEN1KMT2A | |
| SCHEMBL3630265 | 0.77 | F10 (0.37) | F10ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL3087886 | 0.75 | ALDH1A1 (0.55) | CA12CA1CA2CA9CA7 | |
| SCHEMBL3630355 | 0.75 | PIK3CB (0.39) | F10CA12CA1CA2CA9 | |
| SCHEMBL3627366 | 0.73 | SMO (0.43) | — |
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-2150255-A1 | QUINOXALINE DERIVATIVES AS P13 KINASE INHIBITORS | Smithkline Beecham Corporation (US) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008141065-A1 | QUINOXALINE DERIVATIVES AS P13 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-11-20 | — | — | WO | disclosed |