Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 5/20 | 0.33 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17133242 | 0.94 | EPHX1 (0.37) | EPHX1PAOXCA3CA5ACA5B | |
| SCHEMBL17133248 | 0.91 | EPHX1 (0.41) | EPHX1 | |
| SCHEMBL17133236 | 0.88 | EPHX1 (0.47) | EPHX1PAOX | |
| SCHEMBL17133225 | 0.86 | KEAP1 (0.33) | EPHX1PAOXCA3CA5ACA5B | |
| SCHEMBL17133216 | 0.86 | EPHX1 (0.49) | EPHX1PAOX | |
| SCHEMBL17133259 | 0.84 | KEAP1 (0.34) | EPHX1PAOXCA3CA5ACA5B | |
| SCHEMBL2566017 | 0.84 | EPHX1 (0.47) | EPHX1 | |
| SCHEMBL4419366 | 0.84 | EPHX1 (0.47) | EPHX1 | |
| SCHEMBL30325707 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL30325634 | 0.82 | ALDH1A1 (0.32) | — |
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-2015144384-A1 | SILANE CONTAINING RESPECTIVELY AT LEAST TWO ALKOXY GROUPS AND A GUANIDONO OR CARBAMIDE GROUP | EVONIK DEGUSSA GMBH (DE) | 2015-10-01 | — | — | WO | disclosed |