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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 10/20 | 0.52 |
| ▸ | SLC6A4 known ✓ | P31645 | 8/20 | 0.52 |
| ▸ | SLC6A3 known ✓ | Q01959 | 5/20 | 0.52 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
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 SCHEMBL7442255 | 1.00 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| Oxalic Acid SCHEMBL7329503 | 0.88 | OPRD1 (0.51) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| Formic Acid SCHEMBL21381648 | 0.85 | OPRD1 (0.45) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL7319671 | 0.84 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| Hydrochloric Acid SCHEMBL9768345 | 0.83 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL7325604 | 0.82 | OPRD1 (0.53) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL21382056 | 0.82 | OPRD1 (0.53) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL30149800 | 0.82 | OPRD1 (0.53) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL21382026 | 0.82 | OPRD1 (0.53) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| Oxalic Acid SCHEMBL7441568 | 0.81 | OPRD1 (0.44) | SLC6A2SLC6A4SLC6A3OPRD1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5070087-A | Aryl(alkyland alkylene)-N-((phenoxy and phenylthio)alkyl) aminoheterocyclics as cardiovascular, anthihistaminic, antisecretory and antiallergy agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-12-03 | — | — | US | disclosed |
| US-4950674-A | Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1990-08-21 | — | — | US | disclosed |
| US-4810713-A | Arylalkyl-heterocyclic amines, n-substituted by aryloxyalkyl groups used in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-03-07 | — | — | US | disclosed |
| EP-0235463-A2 | N-substituted-arylalkyl and arylalkylene piperidines as cardiovascular antihistaminic and antisecretory agents | A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) | 1987-09-09 | — | — | EP | disclosed |