Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | CBX7 | O95931 | 1/20 | 0.37 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.37 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.37 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25866149 | 0.82 | CBX7 (0.38) | SIGMAR1CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL25310581 | 0.82 | NPC1 (0.40) | SIGMAR1CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL30476259 | 0.78 | USP30 (0.44) | — | |
| SCHEMBL29704410 | 0.75 | SIGMAR1 (0.47) | SIGMAR1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL614398 | 0.75 | SIGMAR1 (0.47) | SIGMAR1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL25309770 | 0.74 | L3MBTL1 (0.37) | SIGMAR1CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL31426197 | 0.69 | CRBN (0.54) | CHRM2DDB1CRBN | |
| SCHEMBL31426196 | 0.69 | CRBN (0.54) | CHRM2DDB1CRBN | |
| SCHEMBL782891 | 0.69 | SIGMAR1 (0.57) | SIGMAR1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL5546317 | 0.68 | SIGMAR1 (0.44) | SIGMAR1CBX7CDYL2CDYLCDY1; CDY1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023134656-A1 | PEPTIDYL NITRILE COMPOUND AND USE THEREOF | 上海壹典医药科技开发有限公司 | 2023-07-20 | — | — | WO | disclosed |