Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CRHR1 | P34998 | 6/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 10/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.36 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL188683 | 0.91 | ALDH1A1 (0.57) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL189196 | 0.79 | HSD17B10 (0.59) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL189483 | 0.77 | ALDH1A1 (0.60) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL14548188 | 0.77 | ALDH1A1 (0.53) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL189211 | 0.76 | PIK3CA (0.67) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL188808 | 0.75 | PIK3CA (0.71) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL188692 | 0.71 | ALDH1A1 (0.60) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL188697 | 0.70 | ALDH1A1 (0.61) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL190012 | 0.69 | KDM4E (0.60) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL189082 | 0.69 | ALDH1A1 (0.57) | KDM4EALDH1A1GLAGAAHPGD |
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-2056829-B9 | USING PI3K AND MEK MODULATORS IN TREATMENTS OF CANCER | EXELIXIS INC (US) | 2012-09-26 | — | — | EP | disclosed |