Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.48 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.48 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.48 |
| ▸ | CHRNG | P07510 | 2/20 | 0.48 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.48 |
| ▸ | CHRND | Q07001 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8137336 | 0.85 | POLB (0.64) | ADRA2AADRA2BADRA2CCYP2A6CYP3A4 | |
| SCHEMBL23646289 | 0.81 | ADRA1D (0.57) | ADRA2AADRA2BADRA2CCYP3A4ALDH1A1 | |
| SCHEMBL2216120 | 0.80 | TSHR (0.49) | ADRA2AADRA2BADRA2CCYP2A6CYP3A4 | |
| SCHEMBL5752973 | 0.80 | ADRA2A (0.60) | ADRA2AADRA2BADRA2CCYP2A6CYP3A4 | |
| SCHEMBL30026143 | 0.80 | CYP2A6 (0.70) | ADRA2CCYP2A6CYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL20541087 | 0.80 | CYP2A6 (0.70) | ADRA2CCYP2A6CYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL5377626 | 0.79 | ADRA1D (0.48) | ADRA2AADRA2BADRA2CCYP2A6CYP3A4 | |
| SCHEMBL28760328 | 0.78 | ADRA1D (0.54) | ADRA2AADRA2BADRA2CCYP3A4ALDH1A1 | |
| SCHEMBL21110859 | 0.78 | CYP2A6 (0.67) | ADRA2CCYP2A6CYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL12853987 | 0.78 | CYP2A6 (0.67) | ADRA2CCYP2A6CYP3A4ALDH1A1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0148826-A1 | FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1985-07-24 | — | — | EP | disclosed |
| WO-1985000289-A1 | FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS | CHEVRON RESEARCH COMPANY (US) | 1985-01-31 | — | — | WO | disclosed |
| US-4407806-A | PRE- AND POSTEMERGENCE HERBICIDES | CHEVRON RESEARCH COMPANY (US) | 1983-10-04 | — | — | US | disclosed |