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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.37 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.71 |
| ▸ | HCAR2 | Q8TDS4 | 6/20 | 0.64 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.43 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.37 |
| ▸ | GABRR2 | P28476 | 2/20 | 0.37 |
| ▸ | BLM | P54132 | 2/20 | 0.37 |
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 SCHEMBL8712024 | 1.00 | ALOX15 (0.71) | ALOX15HCAR2TSHRTP53EGLN1 | |
| Maleic Acid SCHEMBL8337803 | 1.00 | ALOX15 (0.71) | ALOX15HCAR2TSHRTP53EGLN1 | |
| Crotonic Acid SCHEMBL1286417 | 0.89 | ALOX15 (0.62) | ALOX15HCAR2TSHRALDH1A1LMNA | |
| Urethane SCHEMBL17688442 | 0.89 | ALOX15 (0.62) | ALOX15HCAR2TSHRALDH1A1LMNA | |
| Crotonic Acid SCHEMBL1286419 | 0.89 | ALOX15 (0.62) | ALOX15HCAR2TSHRALDH1A1LMNA | |
| Urethane SCHEMBL27766653 | 0.87 | — | — | |
| Urethane SCHEMBL154279 | 0.85 | ALOX15 (0.88) | ALOX15HCAR2TSHREGLN1ALDH1A1 | |
| Urethane SCHEMBL4556053 | 0.85 | ALOX15 (0.88) | ALOX15HCAR2TSHREGLN1ALDH1A1 | |
| Urethane SCHEMBL40457 | 0.85 | ALOX15 (0.88) | ALOX15HCAR2TSHREGLN1ALDH1A1 | |
| Urethane SCHEMBL367439 | 0.84 | ALOX15 (1.00) | ALOX15HCAR2TSHRALDH1A1LMNA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0508617-B1 | Magnetic paint material and process for producing the same | TODA KOGYO CORP (JP) | 1997-02-26 | — | — | EP | claimed |
| EP-0508617-A1 | Magnetic paint material and process for producing the same | TODA KOGYO CORP. (JP) | 1992-10-14 | — | — | EP | claimed |
| EP-0883650-A4 | — | — | 1999-01-27 | — | — | EP | disclosed |
| EP-0883650-A1 | BISPHENOL-A BASED POLYMERS HAVING LOW ORGANIC EMISSIONS | Aristech Chemical Corporation (US) | 1998-12-16 | — | — | EP | disclosed |
| US-5780546-A | CONTAINING A DI-ALKOXYLATED BISPHENOL A-DIMALEATE URETHANE DIMETHACRYLATE HYBRID RESIN, AN ALKOXYLATED BISPHENOL A-DI(METH)ACRYLATE, ETHYLENE GLYCOL DIMETHACRYLATE AND AN OTHER VINYL MONOMER | ARISTECH CHEMICAL CORPORATION (US) | 1998-07-14 | — | — | US | disclosed |
| US-5776963-A | ANTIPSYCHOTIC AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1998-07-07 | — | — | US | disclosed |
| WO-1998026003-A1 | BISPHENOL-A BASED POLYMERS HAVING LOW ORGANIC EMISSIONS | ARISTECH CHEMICAL CORPORATION (US) | 1998-06-18 | — | — | WO | disclosed |