Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | BACE1 | P56817 | 3/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.34 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | PTGES | O14684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29055105 | 1.00 | CA1 (0.36) | CA1CA2BACE1APPITGB1 | |
| SCHEMBL30525113 | 0.90 | RIPK2 (0.37) | CA1CA2BACE1ITGB1ITGA4 | |
| SCHEMBL29055153 | 0.90 | RIPK2 (0.37) | CA1CA2BACE1ITGB1ITGA4 | |
| SCHEMBL30525139 | 0.88 | ITGB1 (0.41) | CA1CA2ITGB1ITGA4SMN1; SMN2 | |
| SCHEMBL29055134 | 0.88 | ITGB1 (0.41) | CA1CA2ITGB1ITGA4SMN1; SMN2 | |
| SCHEMBL29055091 | 0.87 | CA1 (0.35) | CA1CA2ITGB1ITGA4SSTR5 | |
| SCHEMBL30525119 | 0.87 | CA1 (0.35) | CA1CA2ITGB1ITGA4SSTR5 | |
| SCHEMBL29055076 | 0.87 | CA1 (0.35) | CA1CA2ITGB1ITGA4SSTR5 | |
| SCHEMBL30525126 | 0.87 | CA1 (0.35) | CA1CA2ITGB1ITGA4SSTR5 | |
| SCHEMBL29055096 | 0.87 | CA1 (0.35) | CA1CA2ITGB1ITGA4SSTR5 |
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 |