Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16729337 | 0.94 | — | — | |
| SCHEMBL16716806 | 0.94 | ALDH1A1 (0.42) | ALDH1A1EPHX1CYP1A2TSHR | |
| SCHEMBL16716812 | 0.80 | ALDH1A1 (0.42) | ALDH1A1EPHX1CYP1A2 | |
| SCHEMBL16716807 | 0.77 | PRKCA (0.33) | — | |
| SCHEMBL16729083 | 0.77 | PRKCA (0.33) | — | |
| SCHEMBL16729079 | 0.77 | PRKCA (0.33) | — | |
| SCHEMBL14193315 | 0.74 | ALDH1A1 (0.46) | ALDH1A1EPHX1CYP1A2 | |
| SCHEMBL7550175 | 0.73 | ALDH1A1 (0.44) | ALDH1A1EPHX1CYP1A2TSHR | |
| SCHEMBL16729341 | 0.70 | PRKCA (0.35) | ALDH1A1 | |
| SCHEMBL16716802 | 0.70 | PRKCA (0.35) | ALDH1A1 |
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-2015071292-A1 | METHOD FOR PRODUCING CHIRAL COMPOUNDS | Bergische Universität Wuppertal (DE) | 2015-05-21 | — | — | WO | disclosed |