Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dimethyl Maleate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 known ✓ | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.48 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.40 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | TYR | P14679 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Dimethyl Fumarate SCHEMBL8359467 | 1.00 | NFE2L2 (0.48) | NFE2L2HCAR2KEAP1GFPT1PAOX | |
| Bicarbonate SCHEMBL18662974 | 0.82 | LMNA (0.37) | PAOXALDH1A1LMNAMEN1KMT2A | |
| Urea SCHEMBL27918835 | 0.82 | PAOX (0.34) | PAOXALDH1A1LMNAMEN1KMT2A | |
| Acetone SCHEMBL2390270 | 0.82 | PAOX (0.39) | PAOXALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL4605785 | 0.80 | ATM (0.61) | HCAR2MAPTALDH1A1TDP1ATM | |
| Acetic Acid SCHEMBL28413060 | 0.80 | PAOX (0.38) | PAOXALDH1A1LMNAMEN1KMT2A | |
| Acetic Acid SCHEMBL5065362 | 0.80 | PAOX (0.38) | PAOXALDH1A1LMNAMEN1KMT2A | |
| Acetic Acid SCHEMBL28413059 | 0.80 | PAOX (0.38) | PAOXALDH1A1LMNAMEN1KMT2A | |
| Acetic Acid SCHEMBL3253044 | 0.80 | PAOX (0.38) | PAOXALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL7096198 | 0.80 | ATM (0.50) | NFE2L2HCAR2KEAP1GFPT1KDM4E |
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-6001946-A | Curable silane-encapped compositions having improved performances | WITCO CORPORATION (US) | 1999-12-14 | — | — | US | disclosed |