Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28524299 | 0.84 | PTGS2 (0.42) | PTGS2NFE2L2SMN1; SMN2GAAMAPT | |
| SCHEMBL14686297 | 0.76 | PTGS2 (0.46) | PTGS2NFE2L2SMN1; SMN2MAPT | |
| SCHEMBL14686323 | 0.73 | NFE2L2 (0.54) | PTGS2NFE2L2RAB9ANPC1RELA | |
| SCHEMBL28038591 | 0.71 | PTGS2 (0.33) | PTGS2CA12CA1CA2 | |
| SCHEMBL27587401 | 0.71 | HSD17B10 (0.48) | PTGS2NFE2L2CA12CA1CA2 | |
| SCHEMBL28038585 | 0.71 | ALDH1A1 (0.54) | PTGS2RAB9ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL48607 | 0.70 | ALDH1A1 (0.52) | PTGS2NFE2L2RAB9ASMN1; SMN2PLA2G7 | |
| SCHEMBL29389102 | 0.70 | ALDH1A1 (0.52) | PTGS2NFE2L2RAB9ASMN1; SMN2PLA2G7 | |
| SCHEMBL1547756 | 0.70 | NFE2L2 (0.56) | PTGS2NFE2L2RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL28038583 | 0.70 | PTGS2 (0.35) | PTGS2SMN1; SMN2ALDH1A1CES2CES1 |
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-101180266-B | As the alpha ketoamide compounds of cystatin | Vero Bay (US) | 2015-11-25 | — | — | CN | disclosed |