Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | DPP4 | P27487 | 3/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TLR4 | O00206 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | PREP | P48147 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12731209 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL13497333 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL15088683 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL131355 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL12731212 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL13497329 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL132397 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL130018 | 0.87 | EPHX1 (0.53) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL130090 | 0.84 | EPHX1 (0.50) | EPHX1ALDH1A1GAACTSLCTSB | |
| SCHEMBL5442669 | 0.83 | EPHX1 (0.68) | EPHX1ALDH1A1GAACTSLCTSB |
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-2012028331-A1 | SUBSTITUTED TETRAHYDROPYRROLOPYRAZINE DERIVATIVES | Grünenthal GmbH (DE) | 2012-03-08 | — | — | WO | disclosed |