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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 4/20 | 0.52 |
| ▸ | HTR2C known ✓ | P28335 | 4/20 | 0.52 |
| ▸ | HTR2B known ✓ | P41595 | 4/20 | 0.52 |
| ▸ | DRD2 known ✓ | P14416 | 3/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 2/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 SCHEMBL9451677 | 1.00 | SIGMAR1 (0.52) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451496 | 0.90 | ALDH1A1 (0.47) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451498 | 0.90 | ALDH1A1 (0.47) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451762 | 0.90 | HTR2A (0.51) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451757 | 0.90 | HTR2A (0.51) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451707 | 0.89 | HTR2A (0.50) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451568 | 0.89 | MCHR1 (0.55) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451571 | 0.89 | MCHR1 (0.55) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451701 | 0.89 | HTR2A (0.50) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 | |
| Fumaric Acid SCHEMBL9451692 | 0.88 | MCHR1 (0.52) | SIGMAR1HTR2AHTR2CHTR2BMCHR1 |
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-5260318-A | Phenylpiperidylamines and drugs containing them | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-09 | — | — | US | disclosed |