Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 8/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL4354116 | 0.91 | NPC1 (0.58) | EPHX2NPC1RAB9AALDH1A1 | |
| SCHEMBL4351157 | 0.87 | EPHX2 (0.56) | EPHX2EPHX1ALDH1A1HTT | |
| SCHEMBL27761078 | 0.84 | EPHX2 (0.51) | EPHX2NPC1RAB9AEPHX1ALDH1A1 | |
| SCHEMBL4342327 | 0.81 | NPC1 (0.69) | EPHX2NPC1RAB9AALDH1A1 | |
| SCHEMBL4345459 | 0.79 | MEN1 (0.46) | NPC1RAB9AALDH1A1HTT | |
| SCHEMBL6229394 | 0.79 | ALDH1A1 (0.50) | EPHX2NPC1RAB9AEPHX1ALDH1A1 | |
| SCHEMBL6680564 | 0.77 | ALDH1A1 (0.47) | EPHX2NPC1RAB9AEPHX1ALDH1A1 | |
| SCHEMBL4349474 | 0.76 | EPHX1 (0.58) | EPHX2NPC1RAB9AEPHX1ALDH1A1 | |
| SCHEMBL4347034 | 0.76 | EPHX2 (0.67) | EPHX2EPHX1ALDH1A1HTT | |
| SCHEMBL6672911 | 0.75 | HTT (0.32) | EPHX2NPC1RAB9AALDH1A1HTT |
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-2004030664-A2 | NEW COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2004-04-15 | — | — | WO | claimed |