Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 6/20 | 0.56 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.56 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5175845 | 0.91 | HCAR2 (0.44) | HCAR2NFE2L2KEAP1CTSKATM | |
| SCHEMBL15355448 | 0.91 | HCAR2 (0.44) | HCAR2NFE2L2KEAP1CTSKATM | |
| SCHEMBL2537821 | 0.91 | HCAR2 (0.44) | HCAR2NFE2L2KEAP1CTSKATM | |
| SCHEMBL17955615 | 0.87 | HCAR2 (0.46) | HCAR2NFE2L2KEAP1GFPT1MAPT | |
| SCHEMBL27789549 | 0.84 | HCAR2 (0.43) | HCAR2NFE2L2KEAP1CTSKATM | |
| SCHEMBL5175849 | 0.83 | HCAR2 (0.59) | HCAR2NFE2L2KEAP1CTSKALDH1A1 | |
| SCHEMBL5175099 | 0.83 | HCAR2 (0.59) | HCAR2NFE2L2KEAP1CTSKALDH1A1 | |
| SCHEMBL5175102 | 0.83 | HCAR2 (0.59) | HCAR2NFE2L2KEAP1CTSKALDH1A1 | |
| SCHEMBL18356245 | 0.83 | HCAR2 (0.56) | HCAR2NFE2L2KEAP1GFPT1ALDH1A1 | |
| SCHEMBL16800710 | 0.82 | CTSK (0.37) | HCAR2NFE2L2KEAP1CTSKATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017108960-A1 | METHOD FOR PRODUCING MONOMETHYL FUMARATE COMPOUNDS | RATIOPHARM GMBH (DE) | 2017-06-29 | — | — | WO | disclosed |