Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22147367 | 0.78 | NISCH (0.53) | NISCHCHRNB2CHRNA7CHRNA4 | |
| SCHEMBL18936432 | 0.64 | NISCH (0.38) | NISCHCHRNB2CHRNA7CHRNA4CHRM5 | |
| SCHEMBL3107891 | 0.60 | CHRM5 (0.31) | CHRNB2CHRNA7CHRNA4CHRM5CHRM3 | |
| SCHEMBL28647452 | 0.60 | NISCH (0.34) | NISCH | |
| SCHEMBL17791781 | 0.60 | CHRNB2 (0.44) | CHRNB2CHRNA7CHRNA4CHRM5CHRM3 | |
| SCHEMBL7624475 | 0.59 | L3MBTL1 (0.39) | CHRNB2CHRNA7CHRNA4CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL4787170 | 0.58 | L3MBTL1 (0.38) | CHRNB2CHRNA7CHRNA4CHRM5CHRM3 | |
| SCHEMBL16826680 | 0.57 | NISCH (0.31) | NISCH | |
| SCHEMBL16757447 | 0.57 | NISCH (0.43) | NISCH | |
| SCHEMBL21391659 | 0.57 | NISCH (0.95) | NISCH |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115335372-B | Octahydropyrazinodiazepine diketoning organisms | 南京明德新药研发有限公司 | 2024-01-12 | — | — | CN | disclosed |
| CN-115335372-B | Octahydropyrazinodiazepine diketoning organisms | 南京明德新药研发有限公司 | 2024-01-12 | — | — | CN | disclosed |