Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 17/20 | 0.59 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL423421 | 0.80 | PTGS2 (0.66) | PTGS2 | |
| SCHEMBL17285492 | 0.78 | PTGS2 (0.44) | PTGS2TLR8 | |
| SCHEMBL7931176 | 0.77 | PTGS2 (0.63) | PTGS2TLR8 | |
| SCHEMBL7931174 | 0.77 | PTGS2 (0.62) | PTGS2TLR8 | |
| SCHEMBL8672850 | 0.76 | PTGS2 (0.59) | PTGS2TLR8 | |
| SCHEMBL17038481 | 0.75 | PTGS2 (0.60) | PTGS2 | |
| Water SCHEMBL11131807 | 0.75 | PTGS2 (0.60) | PTGS2TLR8CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21101966 | 0.75 | PTGS2 (0.65) | PTGS2 | |
| SCHEMBL5316867 | 0.73 | PTGS2 (0.66) | PTGS2 | |
| SCHEMBL2646645 | 0.73 | AR (0.43) | HSD11B1 |
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-2019025156-A1 | SUBSTITUTED PYRROLIDINONES, SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2019-02-07 | — | — | WO | disclosed |