Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.34 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL2272805 | 0.82 | PIK3CD (0.46) | HRH3KDM4APIK3CDSCN9APIK3CA | |
| SCHEMBL2268269 | 0.77 | PIK3CD (0.42) | KDM4EMEN1ALDH1A1GAAMAPT | |
| SCHEMBL2274088 | 0.76 | PIK3CA (0.41) | KDM4EMEN1ALDH1A1GAAMAPT | |
| SCHEMBL2274542 | 0.76 | SMN1; SMN2 (0.43) | KDM4ESMN1; SMN2PIK3CDPIK3CA | |
| SCHEMBL2270379 | 0.76 | PIK3CA (0.54) | KDM4EMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL2270052 | 0.73 | PIK3CA (0.43) | KDM4ESMN1; SMN2PIK3CDPIK3CA | |
| SCHEMBL2271370 | 0.69 | PTGES (0.44) | MEN1ALDH1A1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL2274934 | 0.69 | HDAC1 (0.39) | MEN1ALDH1A1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL2274942 | 0.69 | HDAC1 (0.39) | MEN1ALDH1A1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL2272862 | 0.69 | SMN1; SMN2 (0.41) | HRH3KDM4EMEN1ALDH1A1GAA |
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-2539337-A1 | PYRIDO[3,2-D]PYRIMIDINE PI3K DELTA INHIBITOR COMPOUNDS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2013-01-02 | — | — | EP | disclosed |
| WO-2011101429-A1 | PYRIDO[3,2-D]PYRIMIDINE PI3K DELTA INHIBITOR COMPOUNDS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2011-08-25 | — | — | WO | disclosed |