Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 3/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 13/20 | 0.46 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL857243 | 0.93 | PIK3CA (0.53) | CREBBPPIK3CATBK1 | |
| SCHEMBL2727189 | 0.82 | PIK3CA (0.51) | CREBBPPIK3CATBK1 | |
| SCHEMBL2724858 | 0.81 | PIK3CA (0.67) | CREBBPPIK3CATBK1 | |
| SCHEMBL856444 | 0.78 | PIK3CA (0.45) | CREBBPPIK3CATBK1 | |
| SCHEMBL2724976 | 0.78 | PIK3CA (0.46) | PIK3CATBK1 | |
| SCHEMBL7880590 | 0.76 | PIK3CA (0.53) | CREBBPPIK3CARIPK1 | |
| SCHEMBL3277263 | 0.76 | PIK3CA (0.60) | CREBBPPIK3CARIPK1 | |
| SCHEMBL2724324 | 0.76 | LMNA (0.45) | CREBBPPIK3CA | |
| SCHEMBL859228 | 0.76 | PIK3CA (0.44) | CREBBPPIK3CATBK1 | |
| SCHEMBL855899 | 0.74 | PIK3CA (0.51) | CREBBPPIK3CARIPK1 |
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-2640366-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2012068096-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-24 | — | — | WO | disclosed |