Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971751 | 0.88 | KDM4E (0.33) | KDM4EHTTATMALDH1A1HPGD | |
| SCHEMBL7959633 | 0.86 | KDM4E (0.33) | KDM4EHTTATMALDH1A1HPGD | |
| SCHEMBL7957954 | 0.79 | ATM (0.40) | ATM | |
| SCHEMBL7957374 | 0.78 | KDM4E (0.56) | KDM4EHTTATMALDH1A1HPGD | |
| SCHEMBL2374746 | 0.77 | KDM4E (0.31) | KDM4EHTTATM | |
| SCHEMBL2374741 | 0.77 | KDM4E (0.31) | KDM4EHTTATM | |
| SCHEMBL7956857 | 0.77 | ATM (0.43) | ATM | |
| SCHEMBL7949729 | 0.76 | ATM (0.34) | ATM | |
| SCHEMBL2374851 | 0.75 | KDM4E (0.41) | KDM4EHTTATMALDH1A1HPGD | |
| SCHEMBL2374853 | 0.75 | KDM4E (0.41) | KDM4EHTTATMALDH1A1HPGD |
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-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |