Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.51 |
| ▸ | CA1 | P00915 | 6/20 | 0.51 |
| ▸ | CA2 | P00918 | 6/20 | 0.51 |
| ▸ | CA9 | Q16790 | 6/20 | 0.51 |
| ▸ | CA7 | P43166 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CA4 | P22748 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6378122 | 0.85 | CA12 (0.70) | CA12CA1CA2CA9CA7 | |
| SCHEMBL10460537 | 0.83 | CA12 (0.53) | CA12CA1CA2CA9CA7 | |
| SCHEMBL14080761 | 0.81 | CA12 (0.56) | CA12CA1CA2CA9CA7 | |
| SCHEMBL9169172 | 0.81 | CA12 (0.51) | CA12CA1CA2CA9CA7 | |
| SCHEMBL13527258 | 0.81 | CA12 (0.66) | CA12CA1CA2CA9CA7 | |
| SCHEMBL13481191 | 0.81 | CA12 (0.70) | CA12CA1CA2CA9CA7 | |
| SCHEMBL720372 | 0.80 | CA12 (0.50) | CA12CA1CA2CA9CA7 | |
| SCHEMBL28571739 | 0.80 | CA12 (0.50) | CA12CA1CA2CA9CA7 | |
| SCHEMBL9453006 | 0.80 | TSHR (0.64) | CA12CA1CA2CA9CA7 | |
| SCHEMBL11430372 | 0.79 | KCNA3 (0.50) | L3MBTL1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112979693-B | Alkyl trimethyl tin compounds, and preparation method and application thereof | 天津师范大学 | 2023-03-28 | — | — | CN | disclosed |
| CN-112979693-A | Alkyl trimethyl tin compounds, and preparation method and application thereof | 天津师范大学 | 2021-06-18 | — | — | CN | disclosed |
| CN-109575063-B | Boron esterification reaction method of alkyl halide without transition metal catalysis | 北京大学 | 2020-06-26 | — | — | CN | disclosed |