Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 20/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 20/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 20/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL115890 | 1.00 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL28205007 | 1.00 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL2180925 | 0.90 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL794941 | 0.89 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL14844401 | 0.85 | SLC6A4 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL115415 | 0.85 | SLC6A4 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14844322 | 0.85 | SLC6A4 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2180437 | 0.81 | SLC6A4 (0.41) | SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4 | |
| SCHEMBL118703 | 0.81 | TSHR (0.41) | SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4 | |
| SCHEMBL901681 | 0.78 | OPRM1 (0.40) | SLC6A2SLC6A4SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107835803-A | Insecticidal aryl-pyrrolidine alkane, its preparation method and its it is used to prevent and treat the purposes of animal pest as reagent | 拜耳作物科学股份公司 | 2018-03-23 | — | — | CN | disclosed |
| WO-2016180802-A1 | INSECTICIDAL ARYLPYRROLIDINES, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF AS AGENTS FOR CONTROLLING ANIMAL PESTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-11-17 | — | — | WO | disclosed |