Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL680853 | 0.78 | NPC1 (0.45) | MAPK1KDM4EALDH1A1GLAGAA | |
| SCHEMBL845813 | 0.77 | CDK8 (0.37) | PPARAMAPK1 | |
| Hydrochloric Acid SCHEMBL4456673 | 0.77 | NPC1 (0.44) | MAPK1KDM4EALDH1A1GLAGAA | |
| SCHEMBL31547968 | 0.77 | MAPK1 (0.41) | MAPK1 | |
| SCHEMBL30850541 | 0.74 | PPARA (0.35) | PPARAMAPK1 | |
| SCHEMBL18725509 | 0.73 | PDK2 (0.31) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL30677345 | 0.73 | QPCT (0.50) | MAPK1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30850625 | 0.73 | KDM4E (0.34) | MAPK1KDM4EALDH1A1GLAGAA | |
| SCHEMBL30850674 | 0.73 | PIK3CA (0.39) | ALDH1A1 | |
| SCHEMBL3027716 | 0.73 | QPCT (0.50) | MAPK1KDM4EALDH1A1HPGDHSD17B10 |
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-2616469-A1 | INHIBITORS OF PI3K-DELTA AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-07-24 | — | — | EP | disclosed |
| WO-2012037226-A1 | INHIBITORS OF PI3K-DELTA AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-03-22 | — | — | WO | disclosed |