Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL118872 | 0.99 | ALDH1A1 (0.50) | ALDH1A1POLBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7192212 | 0.81 | CYP1A2 (0.50) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9754449 | 0.79 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27377682 | 0.79 | ALDH1A1 (0.61) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5801383 | 0.78 | CYP1A2 (0.48) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Bispyribac SCHEMBL4895772 | 0.77 | CA12 (0.56) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Bispyribac SCHEMBL65725 | 0.77 | CA12 (0.56) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9623043 | 0.76 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Bispyribac SCHEMBL9195440 | 0.76 | CA12 (0.54) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Bispyribac SCHEMBL238471 | 0.76 | CA12 (0.54) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 |
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-2021132941-A1 | HERBICIDE COMPOSITION | 주식회사 엘지화학 | 2021-07-01 | — | — | WO | disclosed |