Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 8/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | MAP3K12 | Q12852 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4726457 | 1.00 | PIK3CB (0.48) | PIK3CBKMT2APIK3CAKDM4EALDH1A1 | |
| SCHEMBL4728179 | 0.87 | PIK3CA (0.43) | PIK3CBPIK3CAMTORATR | |
| SCHEMBL4727861 | 0.79 | PIK3CA (0.37) | PIK3CBPIK3CAMTORMAP3K12ATR | |
| SCHEMBL4731075 | 0.77 | HTT (0.49) | KMT2APIK3CAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL4794320 | 0.77 | PIK3CA (0.48) | PIK3CBPIK3CAKDM4EALDH1A1GLA | |
| SCHEMBL4797718 | 0.77 | PIK3CB (0.40) | PIK3CBKMT2APIK3CAKDM4EALDH1A1 | |
| SCHEMBL4572916 | 0.75 | PIK3CB (0.44) | PIK3CBPIK3CAPIK3CD | |
| SCHEMBL4574510 | 0.75 | PIK3CB (0.44) | PIK3CBPIK3CAPIK3CD | |
| SCHEMBL4730678 | 0.75 | PIK3CB (0.44) | PIK3CBPIK3CAPIK3CD | |
| SCHEMBL4730536 | 0.74 | ATR (0.43) | PIK3CBKMT2APIK3CAKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008032036-A1 | 6-BENZIMIDAZ0LYL-2-M0RPH0LIN0-4- (AZETIDINE, PYRROLIDINE, PIPERIDINE OR AZEPINE) PYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-03-20 | — | — | WO | disclosed |