Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | PTAFR | P25105 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7517692 | 1.00 | PTGS2 (0.44) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL7526386 | 0.92 | PTGS2 (0.40) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL7517699 | 0.92 | PDCD1 (0.46) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL7526394 | 0.87 | PDCD1 (0.38) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL6563502 | 0.83 | PDCD1 (0.48) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL6563509 | 0.83 | PDCD1 (0.48) | PTGS2PDCD1CD274SCN1ASCN2A | |
| SCHEMBL6547284 | 0.81 | MAPT (0.44) | PTGS2PDCD1CD274EGFRHCRTR1 | |
| SCHEMBL6547277 | 0.79 | MAPT (0.42) | PTGS2PDCD1CD274HCRTR1HCRTR2 | |
| SCHEMBL9850409 | 0.77 | RARB (0.48) | PTAFRMAPTALDH1A1 | |
| SCHEMBL9350092 | 0.77 | ALDH1A1 (0.45) | PTGS2ALDH1A1SMN1; SMN2L3MBTL1HPGD |
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 |