Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 6/20 | 0.42 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL18194512 | 0.79 | TSHR (0.40) | AOC3DPP4F2CYP3A4ALOX15 | |
| SCHEMBL10696840 | 0.77 | AOC3 (0.42) | AOC3DPP4F2CTSDCYP3A4 | |
| SCHEMBL3297829 | 0.76 | ALDH1A1 (0.46) | CTSDCYP3A4ALOX15TSHRALDH1A1 | |
| SCHEMBL10710968 | 0.72 | CYP2D6 (0.40) | CTSD | |
| SCHEMBL28550055 | 0.72 | EPHX1 (0.41) | CTSDCYP3A4ALOX15TSHRTAAR1 | |
| Hydrochloric Acid SCHEMBL4797236 | 0.71 | DPP4 (0.48) | DPP4F2HTR2ATAAR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10786964 | 0.70 | CYP3A4 (0.54) | AOC3DPP4F2CTSDCYP3A4 | |
| SCHEMBL3294115 | 0.69 | KDM4E (0.42) | ALDH1A1 | |
| SCHEMBL3292771 | 0.69 | ALDH1A1 (0.46) | CYP3A4ALOX15ALDH1A1MAPT | |
| SCHEMBL3300265 | 0.69 | MAPT (0.42) | CYP3A4TSHRALDH1A1MAPT |
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-2009010156-A2 | SUBSTITUTED PHENYLPROPOARGYL COMPOUNDS, METHODS FOR THE PRODUCTION THEREOF, AND USE OF SAME AS HERBICIDES AND PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AG (DE) | 2009-01-22 | — | — | WO | disclosed |