Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 5/20 | 0.52 |
| ▸ | CCND1 | P24385 | 5/20 | 0.52 |
| ▸ | CCND2 | P30279 | 5/20 | 0.52 |
| ▸ | CCND3 | P30281 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL189479 | 0.90 | ALDH1A1 (0.66) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL189237 | 0.78 | HSD17B10 (0.69) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL189165 | 0.77 | FGFR1 (0.51) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL189369 | 0.76 | ALDH1A1 (0.63) | ALDH1A1HSD17B10KDM4EGLAGAA | |
| SCHEMBL188479 | 0.75 | WEE1 (0.45) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL189950 | 0.75 | RIPK2 (0.49) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL189050 | 0.73 | WEE1 (0.47) | CDK4CCND1CCND3SRCCCNA2 | |
| SCHEMBL188663 | 0.73 | ALDH1A1 (0.65) | ALDH1A1HSD17B10KDM4EGLAGAA | |
| SCHEMBL2632910 | 0.73 | PIK3CA (0.50) | ALDH1A1HSD17B10KDM4EGLAGAA | |
| SCHEMBL3339784 | 0.73 | KDM4E (0.58) | CDK4CCND1CCND2CCND3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1931670-B1 | PYRIDOPYRIMIDINONE INHIBITORS OF PI3K | EXELIXIS INC (US) | 2012-09-12 | — | — | EP | disclosed |