Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CBX7 | O95931 | 2/20 | 0.55 |
| ▸ | CDYL | Q9Y232 | 2/20 | 0.55 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 2/20 | 0.55 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 4/20 | 0.45 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | CD74 | P04233 | 3/20 | 0.44 |
| ▸ | MIF | P14174 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26614669 | 0.87 | SIGMAR1 (0.54) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL616373 | 0.83 | SIGMAR1 (0.53) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL30336433 | 0.83 | SIGMAR1 (0.53) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL25866127 | 0.83 | CBX7 (0.52) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL5416540 | 0.83 | CBX7 (0.62) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL30660242 | 0.83 | CBX7 (0.62) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL26614693 | 0.83 | CBX7 (0.52) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL16932296 | 0.81 | CBX7 (0.60) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL4426587 | 0.81 | HPGD (0.64) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 | |
| SCHEMBL30538038 | 0.81 | CBX7 (0.60) | CBX7CDYLCDY1; CDY1BCDYL2SIGMAR1 |
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 |