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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26021 | 0.89 | CYP4F2 (0.37) | CYP4F2CYP4A11 | |
| Acrylic Acid SCHEMBL4622901 | 0.88 | ALDH1A1 (0.38) | TP53CYP4F2CYP4A11 | |
| SCHEMBL11210783 | 0.87 | HCAR2 (0.44) | HCAR2TP53 | |
| SCHEMBL12403725 | 0.85 | CYP4F2 (0.35) | CYP4F2CYP4A11 | |
| SCHEMBL27696058 | 0.83 | ALDH1A1 (0.34) | TP53CYP4F2CYP4A11 | |
| SCHEMBL12403723 | 0.82 | CYP4F2 (0.38) | TP53CYP4F2CYP4A11 | |
| SCHEMBL11805690 | 0.81 | HCAR2 (0.53) | HCAR2TSHRTP53EGLN1EGLN3 | |
| SCHEMBL3627793 | 0.81 | HCAR2 (0.53) | HCAR2TSHRTP53EGLN1EGLN3 | |
| Methacrylic Acid SCHEMBL6737902 | 0.81 | CYP4F2 (0.31) | CYP4F2CYP4A11 | |
| Acetoacetic Acid SCHEMBL9574542 | 0.79 | KDM4E (0.31) | CYP4F2CYP4A11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0020945-B1 | COMPOSITIONS CONTAINING HALF ESTERS OF ORGANIC POLYOLS, A PROCESS FOR THEIR PRODUCTION AND USE OF THE COMPOSITIONS IN THE PRODUCTION OF MOULDED ARTICLES | UNION CARBIDE CORPORATION (US) | 1983-05-25 | — | — | EP | disclosed |
| US-4263413-A | CURING ACRYLIC COPOLYMERS | UNION CARBIDE CORPORATION (US) | 1981-04-21 | — | — | US | disclosed |