Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | ITK | Q08881 | 3/20 | 0.31 |
| ▸ | EGFR | P00533 | 2/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | KCNQ4 | P56696 | 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 | |
|---|---|---|---|---|
| SCHEMBL25839689 | 0.93 | JAK2 (0.33) | JAK2NTRK1SCN9AALDH1A1KDM4E | |
| SCHEMBL25839652 | 0.91 | ALDH1A1 (0.31) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839690 | 0.87 | JAK2 (0.35) | JAK2NTRK1SCN9AALDH1A1KDM4E | |
| SCHEMBL25118111 | 0.85 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839656 | 0.84 | ALDH1A1 (0.33) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839577 | 0.83 | ALDH1A1 (0.35) | JAK2NTRK1ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL25416742 | 0.81 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25842417 | 0.81 | ALDH1A1 (0.40) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25171195 | 0.79 | JAK3 (0.33) | JAK2ALDH1A1KDM4EL3MBTL1HPGD | |
| SCHEMBL25117806 | 0.78 | KDM4E (0.40) | JAK2NTRK1SCN9AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-4163283-A1 | COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF | Scinnohub Pharmaceutical Co., Ltd (CN) | 2023-04-12 | — | — | EP | disclosed |