Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Monomethyl Fumarate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 known ✓ | Q14145 | 1/20 | 0.54 |
| ▸ | HCAR2 | Q8TDS4 | 9/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.38 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Monomethyl Fumarate SCHEMBL7764250 | 0.89 | HCAR2 (0.81) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Fumaric Acid SCHEMBL3701419 | 0.87 | HSD17B10 (0.52) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Maleic Acid SCHEMBL251369 | 0.87 | HSD17B10 (0.52) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| SCHEMBL4168638 | 0.85 | HCAR2 (0.52) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| SCHEMBL1014778 | 0.85 | HCAR2 (0.52) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Monomethyl Fumarate SCHEMBL5607806 | 0.84 | HCAR2 (0.90) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Fumaric Acid SCHEMBL9248586 | 0.84 | HSD17B10 (0.50) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Maleic Acid SCHEMBL4507841 | 0.84 | HSD17B10 (0.50) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Monomethyl Fumarate SCHEMBL5607800 | 0.84 | HCAR2 (0.90) | HCAR2ALDH1A1TDP1KDM4EMAPT | |
| Monomethyl Fumarate SCHEMBL25280962 | 0.84 | HCAR2 (1.00) | HCAR2ALDH1A1TDP1KDM4EMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030139502-A1 | Cosmetic compositions comprising a cationic polymer/anionic surfactant mixture and use of said mixture as conditioning agent | RHODIA CHIMIE (FR) | 2003-07-24 | — | — | US | disclosed |
| US-4265778-A | FATTY ACID SALT, INTERPOLYMER OF A MALEIC ANHYDRIDE OR ACID AND A VINYL LACTAM OR VINYL ETHER OR ESTER | COLGATE-PALMOLIVE COMPANY (US) | 1981-05-05 | — | — | US | disclosed |