Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2058083 | 0.83 | CA1 (0.32) | CA1CA2 | |
| SCHEMBL14778335 | 0.83 | CA1 (0.32) | CA1CA2 | |
| SCHEMBL13166648 | 0.81 | CYP2C19 (0.35) | CYP2C19 | |
| SCHEMBL2057492 | 0.80 | CA1 (0.33) | CA1CA2 | |
| SCHEMBL30731572 | 0.79 | — | — | |
| SCHEMBL11979484 | 0.79 | CYP2C19 (0.33) | CYP2C19 | |
| SCHEMBL22007022 | 0.79 | CA1 (0.36) | CA1CA2 | |
| SCHEMBL2103021 | 0.77 | CYP2C19 (0.39) | CYP2C19CA1CA2 | |
| SCHEMBL4132962 | 0.76 | CA1 (0.54) | CA1CA2 | |
| SCHEMBL2057269 | 0.76 | CA1 (0.31) | CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113453554-B | herbicidal composition | 先正达农作物保护股份公司 | 2023-09-05 | — | — | CN | disclosed |