Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | NPY2R | P49146 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PTPRF | P10586 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7517697 | 0.92 | PTGS2 (0.44) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL7517692 | 0.92 | PTGS2 (0.44) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL7526394 | 0.88 | PDCD1 (0.38) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL7526386 | 0.86 | PTGS2 (0.40) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL6563516 | 0.85 | PDCD1 (0.48) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL6563502 | 0.82 | PDCD1 (0.48) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL6563509 | 0.82 | PDCD1 (0.48) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL6547348 | 0.80 | PDCD1 (0.57) | PDCD1CD274EGFRMAPTSMN1; SMN2 | |
| SCHEMBL6547277 | 0.78 | MAPT (0.42) | PDCD1CD274MAPTPTGS2PTPRC | |
| SCHEMBL6547284 | 0.77 | MAPT (0.44) | PDCD1CD274EGFRMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020146517-A1 | Optically active compound and liquid crystal composition containing the compound | MITSUBISHI GAS CHEMICAL COMPANY, INC. | 2002-10-10 | — | — | US | disclosed |