Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.57 |
| ▸ | ATM | Q13315 | 4/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL1821725 | 0.83 | BACE1 (0.49) | KDM4EATMHTTPGREPHX2 | |
| SCHEMBL12246676 | 0.83 | KDM4E (0.43) | KDM4EATMHTTEPHX2KMT2A | |
| SCHEMBL12246645 | 0.79 | BACE1 (0.41) | KDM4EATMHTTEPHX2EPHX1 | |
| SCHEMBL2374444 | 0.79 | BACE1 (0.48) | PGR | |
| SCHEMBL1823947 | 0.77 | KDM4E (0.51) | KDM4EATMHTTEPHX2KMT2A | |
| SCHEMBL1820865 | 0.77 | KDM4E (0.44) | KDM4EATMHTTEPHX2EPHX1 | |
| SCHEMBL7959142 | 0.74 | BACE1 (0.45) | KDM4EATMHTTPGR | |
| SCHEMBL12246718 | 0.74 | KDM4E (0.41) | KDM4EATMHTTEPHX2KMT2A | |
| SCHEMBL618205 | 0.74 | KDM4E (0.94) | KDM4EATMHTTACACBKMT2A | |
| SCHEMBL4350772 | 0.74 | KDM4E (1.00) | KDM4EATMHTTACACBKMT2A |
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 |