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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.46 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7723600 | 0.85 | PARP1 (0.61) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL7723603 | 0.85 | PARP1 (0.61) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL7171129 | 0.84 | GPR52 (0.51) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL7568121 | 0.84 | GPR52 (0.51) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL6519835 | 0.78 | CTNNB1 (0.48) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL8559364 | 0.76 | PARP1 (0.55) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL10546316 | 0.76 | KCNK3 (0.51) | SMN1; SMN2HDAC8HDAC6PARP1KCNK3 | |
| SCHEMBL20686435 | 0.75 | PARP1 (0.53) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL13864071 | 0.74 | HDAC8 (0.50) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 | |
| SCHEMBL15999780 | 0.74 | HDAC8 (0.43) | SMN1; SMN2MAPTALDH1A1HDAC8HDAC6 |
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-20020177678-A1 | Stabilized with a dialkyl maleate; suitable for making polyvinyl chloride for food contact use | ATOFINA CHEMICALS, INC. | 2002-11-28 | — | — | US | disclosed |