Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CDC7 | O00311 | 5/20 | 0.38 |
| ▸ | DBF4 | Q9UBU7 | 5/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 2/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | HRH2 | P25021 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29055112 | 0.90 | CA1 (0.37) | CA1CA2CDC7DBF4SSTR5 | |
| SCHEMBL30525139 | 0.90 | ITGB1 (0.41) | CA1CA2ITGB1ITGA4ALDH1A1 | |
| SCHEMBL29055134 | 0.90 | ITGB1 (0.41) | CA1CA2ITGB1ITGA4ALDH1A1 | |
| SCHEMBL30525136 | 0.87 | CA1 (0.37) | CA1CA2SSTR5ITGB1ITGA4 | |
| SCHEMBL29055137 | 0.87 | CA1 (0.37) | CA1CA2SSTR5ITGB1ITGA4 | |
| SCHEMBL29055105 | 0.87 | CA1 (0.36) | CA1CA2SSTR5ITGB1ITGA4 | |
| SCHEMBL30525129 | 0.87 | CA1 (0.36) | CA1CA2SSTR5ITGB1ITGA4 | |
| SCHEMBL29055122 | 0.87 | RAF1 (0.38) | CA1CA2SSTR5 | |
| SCHEMBL29055150 | 0.85 | CA1 (0.46) | CA1CA2SSTR5ITGB1ITGA4 | |
| SCHEMBL29055129 | 0.85 | CA1 (0.39) | CA1CA2CDC7DBF4SSTR5 |
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-116568673-A | Herbicidal compounds | 先正达农作物保护股份公司 | 2023-08-08 | — | — | CN | disclosed |