Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. 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 | |
|---|---|---|---|---|
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.36 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL11114411 | 1.00 | L3MBTL1 (0.47) | L3MBTL1SMN1; SMN2POLBHPGDMAPK1 | |
| SCHEMBL64923 | 0.84 | ALDH1A1 (0.42) | L3MBTL1SMN1; SMN2POLBHPGDDAO | |
| SCHEMBL30307422 | 0.84 | ALDH1A1 (0.42) | L3MBTL1SMN1; SMN2POLBHPGDDAO | |
| Fumaric Acid SCHEMBL9431713 | 0.81 | SLC6A2 (0.40) | L3MBTL1SMN1; SMN2POLBHPGDMAPK1 | |
| Fumaric Acid SCHEMBL9431708 | 0.81 | SLC6A2 (0.40) | L3MBTL1SMN1; SMN2POLBHPGDMAPK1 | |
| Perchlorate SCHEMBL4790551 | 0.78 | ALDH1A1 (0.36) | L3MBTL1SMN1; SMN2HPGDMAPK1DAO | |
| SCHEMBL6851190 | 0.73 | BAZ2B (0.45) | L3MBTL1SMN1; SMN2POLBKDM4ETSHR | |
| SCHEMBL366723 | 0.70 | MAPT (0.45) | L3MBTL1SMN1; SMN2POLBHPGDMAPK1 | |
| Naphthalene SCHEMBL2834571 | 0.70 | HCAR2 (0.56) | RAB9AKDM4ETSHRALDH1A1MAPT | |
| Naphthalene SCHEMBL2834576 | 0.70 | HCAR2 (0.56) | RAB9AKDM4ETSHRALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0115920-A2 | Pyrazino(2',3'-3,4)pyrido(1,2-a) indole derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1984-08-15 | — | — | EP | disclosed |