Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.50 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 6/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 3/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18031102 | 0.81 | CA1 (0.56) | CA1CA2CA12CA9S1PR1 | |
| SCHEMBL22897782 | 0.81 | CA1 (0.56) | CA1CA2CA12CA9S1PR1 | |
| SCHEMBL23557702 | 0.81 | CA1 (0.56) | CA1CA2CA12CA9S1PR1 | |
| SCHEMBL28338995 | 0.80 | MIF (0.56) | CA1CA2CA12CA9KEAP1 | |
| SCHEMBL29158482 | 0.80 | PTGS2 (0.65) | CA1CA2CA12CA9KEAP1 | |
| SCHEMBL28964572 | 0.80 | MIF (0.56) | CA1CA2CA12CA9KEAP1 | |
| SCHEMBL21814340 | 0.79 | KEAP1 (0.73) | CA1CA2CA12CA9KEAP1 | |
| SCHEMBL23557745 | 0.79 | STS (0.67) | CA1CA2CA12CA9S1PR1 | |
| SCHEMBL1260911 | 0.79 | TLR2 (0.51) | CA1CA2CA12CA9PSD | |
| SCHEMBL1242136 | 0.77 | PGR (0.52) | CA1CA2CA12CA9PSD |
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-114072000-A | Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2022-02-18 | — | — | CN | disclosed |
| WO-2021011722-A1 | MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2021-01-21 | — | — | WO | disclosed |