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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 known ✓ | P35367 | 1/20 | 0.54 |
| ▸ | HTR2A known ✓ | P28223 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | TACR2 | P21452 | 1/20 | 0.54 |
| ▸ | TACR1 | P25103 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9695606 | 0.94 | POLB (0.62) | POLBKDM4ETACR2TACR1HRH1 | |
| SCHEMBL3554056 | 0.82 | KDM4E (0.56) | POLBKDM4ETACR2TACR1HRH1 | |
| SCHEMBL9695580 | 0.81 | POLB (0.60) | POLBKDM4ETACR2TACR1HRH1 | |
| Bromide SCHEMBL3553550 | 0.81 | POLB (0.59) | POLBKDM4ETACR2TACR1HRH1 | |
| SCHEMBL13317058 | 0.80 | KDM4E (0.54) | POLBKDM4ETACR2TACR1HRH1 | |
| SCHEMBL9264751 | 0.78 | HRH1 (0.72) | TACR2TACR1HRH1 | |
| SCHEMBL9268450 | 0.74 | TACR2 (0.77) | TACR2TACR1HRH1HTTHTR2A | |
| SCHEMBL9259114 | 0.74 | HRH1 (0.73) | POLBKDM4ETACR2TACR1HRH1 | |
| SCHEMBL9260978 | 0.72 | KDM4E (0.50) | KDM4ETACR2TACR1HRH1 | |
| SCHEMBL9261037 | 0.72 | HRH1 (0.73) | KDM4ETACR2TACR1HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992006086-A1 | NOVEL 4-PIPERIDINYLCARBONYL DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-04-16 | — | — | WO | disclosed |