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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL5326717 | 1.00 | HTT (0.32) | HTTNPC1GAASMN1; SMN2LMNA | |
| SCHEMBL5230968 | 0.89 | KDM4E (0.33) | HTTLMNATSHR | |
| Hydrochloric Acid SCHEMBL5233919 | 0.88 | KDM4E (0.33) | HTTLMNATSHR | |
| Phosphoric Acid SCHEMBL5330172 | 0.83 | ENO1 (0.33) | — | |
| Maleic Acid SCHEMBL5334785 | 0.74 | HTT (0.34) | HTTNPC1GAASMN1; SMN2LMNA | |
| Fumaric Acid SCHEMBL5334788 | 0.69 | HTT (0.40) | HTTNPC1GAASMN1; SMN2TSHR | |
| Maleic Acid SCHEMBL5334783 | 0.69 | HTT (0.40) | HTTNPC1GAASMN1; SMN2TSHR | |
| SCHEMBL476025 | 0.62 | LMNA (0.34) | HTTLMNATSHR | |
| SCHEMBL5031774 | 0.62 | LMNA (0.34) | HTTLMNATSHR | |
| Fumaric Acid SCHEMBL28611781 | 0.59 | TSHR (0.47) | HTTNPC1GAASMN1; SMN2LMNA |
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-2007010504-A2 | ACID ADDITION SALTS OF ISOINDOLES ACTING AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-01-25 | — | — | WO | claimed |