Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 8/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 7/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | PDCD1LG2 | Q9BQ51 | 2/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28868545 | 1.00 | ALDH1A1 (0.44) | ALDH1A1S1PR1SYKL3MBTL1S1PR5 | |
| SCHEMBL20296352 | 0.82 | CCR5 (0.43) | ALDH1A1S1PR1SYKPDCD1LG2CD274 | |
| SCHEMBL30740137 | 0.82 | CCR5 (0.43) | ALDH1A1S1PR1SYKPDCD1LG2CD274 | |
| SCHEMBL20296354 | 0.82 | CCR5 (0.43) | ALDH1A1S1PR1SYKPDCD1LG2CD274 | |
| SCHEMBL30021389 | 0.81 | CYP2D6 (0.49) | ALDH1A1L3MBTL1 | |
| SCHEMBL28868539 | 0.81 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1CD274 | |
| SCHEMBL4664521 | 0.77 | FAAH (0.55) | ALDH1A1S1PR1SYKL3MBTL1S1PR5 | |
| SCHEMBL4664522 | 0.77 | FAAH (0.55) | ALDH1A1S1PR1SYKL3MBTL1S1PR5 | |
| SCHEMBL28868640 | 0.76 | CD274 (0.44) | SYKPDCD1LG2CD274 | |
| SCHEMBL28868653 | 0.76 | CYP1A2 (0.48) | CD274 |
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 |