Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 10/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.37 |
| ▸ | TACR2 | P21452 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 3/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL622461 | 0.90 | PIK3CA (0.42) | PIK3CASLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL622870 | 0.88 | PIK3CA (0.54) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 | |
| SCHEMBL623508 | 0.82 | PIK3CA (0.52) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 | |
| SCHEMBL623170 | 0.81 | PIK3CA (0.49) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 | |
| SCHEMBL623337 | 0.79 | PIK3CA (0.58) | PIK3CAGRIA2GRIA4CYP3A4CYP2D6 | |
| SCHEMBL10288545 | 0.79 | PIK3CA (0.55) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 | |
| SCHEMBL622984 | 0.79 | PIK3CA (0.43) | PIK3CASLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL622869 | 0.78 | PIK3CA (0.52) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 | |
| SCHEMBL3403807 | 0.77 | PIK3CA (0.78) | PIK3CAGRIA2GRIA4MTORPIK3R1 | |
| SCHEMBL622051 | 0.77 | PIK3CA (0.55) | PIK3CASLC6A2SLC6A4SLC6A3GRIA2 |
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-2603214-A1 | HETEROARYLS AND USES THEREOF | Millennium Pharmaceuticals, Inc. (US) | 2013-06-19 | — | — | EP | disclosed |
| WO-2012021696-A1 | HETEROARYLS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |