Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | AKT1 | P31749 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 2/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17072195 | 1.00 | NFKB1 (0.39) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL17072194 | 1.00 | NFKB1 (0.39) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL17072190 | 0.91 | CYP3A4 (0.35) | PPARAPPARGAKT1MAPTKDM4E | |
| SCHEMBL17072192 | 0.91 | CYP3A4 (0.35) | PPARAPPARGAKT1MAPTKDM4E | |
| SCHEMBL17072191 | 0.91 | CYP3A4 (0.35) | PPARAPPARGAKT1MAPTKDM4E | |
| SCHEMBL16865340 | 0.84 | PPARA (0.38) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL16865331 | 0.84 | PPARA (0.38) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL16865332 | 0.78 | PPARA (0.43) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL16865382 | 0.78 | PPARA (0.43) | NFKB1NFKB2RELAPPARAGAA | |
| SCHEMBL16865351 | 0.78 | PPARA (0.43) | NFKB1NFKB2RELAPPARAGAA |
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-9133488-B2 | Synthetic methods and compounds related thereto | UNIVERSITY OF ALASKA FAIRBANKS (US) | 2015-09-15 | — | — | US | disclosed |