Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 5/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 10/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19946328 | 1.00 | AKR1C3 (0.42) | AKR1C3APEX1TBXAS1HCAR2RXRA | |
| SCHEMBL7140359 | 0.78 | AKR1C3 (0.44) | AKR1C3APEX1 | |
| SCHEMBL7140365 | 0.78 | AKR1C3 (0.44) | AKR1C3APEX1 | |
| SCHEMBL7008624 | 0.78 | AKR1C3 (0.53) | AKR1C3APEX1 | |
| SCHEMBL7008627 | 0.78 | AKR1C3 (0.53) | AKR1C3APEX1 | |
| SCHEMBL466254 | 0.77 | AKR1C3 (0.45) | AKR1C3APEX1TBXAS1 | |
| SCHEMBL263472 | 0.77 | AKR1C3 (0.45) | AKR1C3APEX1TBXAS1 | |
| SCHEMBL4498131 | 0.77 | AKR1C3 (0.42) | AKR1C3APEX1 | |
| SCHEMBL7138000 | 0.74 | AKR1C3 (0.44) | AKR1C3APEX1 | |
| SCHEMBL7137993 | 0.74 | AKR1C3 (0.44) | AKR1C3APEX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2934136-B1 | SUBSTITUTED 4-CYAN-3-(PYRIDYL)-4-PHENYLBUTANOATES, METHOD FOR THE PRODUCTION THEREOF AND USES AS HERBICIDES AND PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AG (DE) | 2018-03-14 | — | — | EP | disclosed |