Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 4/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.30 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.30 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.30 |
| ▸ | CACNA1C | Q13936 | 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 | |
|---|---|---|---|---|
| SCHEMBL28025725 | 0.81 | ALK (0.36) | ALKACACBCACNA2D1CACNB2CACNA1C | |
| SCHEMBL20446355 | 0.81 | LOXL2 (0.44) | ALK | |
| SCHEMBL27669074 | 0.79 | CALM1 (0.41) | ACACBCACNA2D1CACNB2CACNA1C | |
| SCHEMBL16070697 | 0.79 | ACACB (0.49) | ALKACACB | |
| SCHEMBL16070681 | 0.78 | ACACB (0.37) | ALKACACB | |
| SCHEMBL28247328 | 0.76 | GRM5 (0.45) | ACACBCACNA2D1CACNB2CACNA1C | |
| SCHEMBL30283119 | 0.76 | FFAR1 (0.57) | ALK | |
| SCHEMBL16070579 | 0.75 | FFAR1 (0.35) | ALKACACBCACNA2D1CACNB2CACNA1C | |
| SCHEMBL1457390 | 0.75 | APP (0.33) | CACNA2D1CACNB2CACNA1C | |
| SCHEMBL2609821 | 0.75 | ACACB (0.38) | ACACBCACNA2D1CACNB2CACNA1C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112812133-B | Alpha, alpha-difluoroallyl organometallic compound and preparation method and application thereof | 南京工业大学 | 2022-03-11 | — | — | CN | claimed |
| CN-112812133-A | Alpha, alpha-difluoroallyl organometallic compound and preparation method and application thereof | 南京工业大学 | 2021-05-18 | — | — | CN | claimed |
| CN-112812133-B | Alpha, alpha-difluoroallyl organometallic compound and preparation method and application thereof | 南京工业大学 | 2022-03-11 | — | — | CN | disclosed |
| CN-112812133-A | Alpha, alpha-difluoroallyl organometallic compound and preparation method and application thereof | 南京工业大学 | 2021-05-18 | — | — | CN | disclosed |