Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRIM24 | O15164 | 1/20 | 0.53 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.53 |
| ▸ | CCR1 | P32246 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | CCR8 | P51685 | 1/20 | 0.45 |
| ▸ | ERN1 | O75460 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL748190 | 0.80 | CCR1 (0.50) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL30529332 | 0.80 | CCR1 (0.50) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL27887406 | 0.78 | TRIM24 (0.57) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL31207190 | 0.77 | CCR1 (0.47) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL24265348 | 0.77 | CCR1 (0.47) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL29950826 | 0.75 | CCR1 (0.45) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL29954640 | 0.75 | CCR1 (0.45) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL2894661 | 0.75 | CCR1 (0.45) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL19139612 | 0.75 | CCR1 (0.45) | TRIM24TRIM33CCR1CCR5CCR8 | |
| SCHEMBL17512179 | 0.75 | TRIM24 (0.53) | TRIM24TRIM33CCR1CCR5CCR8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115232109-A | PD-1/PD-L1 small molecule inhibitor and application thereof in medicines | 广东东阳光药业有限公司 | 2022-10-25 | — | — | CN | disclosed |