Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.60 |
| ▸ | PIK3CA | P42336 | 9/20 | 0.55 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.55 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13848198 | 0.88 | PIK3CA (0.60) | CYP11B2PIK3CAPIK3CBPIK3CGALDH1A1 | |
| SCHEMBL13848204 | 0.81 | PIK3CA (0.55) | CYP11B2PIK3CAPIK3CBPIK3CGAKT1 | |
| SCHEMBL3990390 | 0.79 | CYP11B2 (0.65) | CYP11B2PIK3CAPIK3CBPIK3CGALDH1A1 | |
| SCHEMBL3990409 | 0.78 | PIK3CA (0.58) | PIK3CAPIK3CBPIK3CGAKT1MAP3K12 | |
| SCHEMBL3989949 | 0.77 | PIK3CA (0.42) | CYP11B2PIK3CAPIK3CBPIK3CGL3MBTL1 | |
| SCHEMBL3993009 | 0.77 | PIK3CA (0.62) | CYP11B2PIK3CAPIK3CBPIK3CGAKT1 | |
| SCHEMBL13848159 | 0.77 | PIK3CA (0.52) | CYP11B2PIK3CAPIK3CBPIK3CGMAP3K12 | |
| SCHEMBL4117117 | 0.76 | HTR1A (0.47) | PIK3CAPIK3CBPIK3CGALDH1A1SMN1; SMN2 | |
| SCHEMBL13848128 | 0.76 | PIK3CA (0.54) | PIK3CAPIK3CBPIK3CGAKT1LMNA | |
| SCHEMBL18489956 | 0.76 | CYP11B2 (1.00) | CYP11B2ALDH1A1SMN1; SMN2ALOX15USP2 |
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-2009066084-A1 | 2 -MORPHOLINOPYRIMIDINES AND THEIR USE AS PI3 KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-05-28 | — | — | WO | claimed |