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 | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.41 |
| ▸ | MEN1 known ✓ | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A known ✓ | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SDCBP | O00560 | 2/20 | 0.44 |
| ▸ | SDC2 | P34741 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL11267111 | 1.00 | TSHR (0.45) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11273023 | 0.87 | KDM4E (0.48) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11273031 | 0.87 | KDM4E (0.48) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11269551 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11130146 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11261354 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11269540 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11130141 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL11261365 | 0.86 | SDCBP (0.46) | TSHRKDM4ECYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11273028 | 0.75 | KDM4E (0.50) | KDM4ECYP1A2CYP2D6CYP2C19SDCBP |
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-0053015-A1 | 1-Phenylthio-2-aminopropane derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1982-06-02 | — | — | EP | disclosed |