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 | |
|---|---|---|---|---|
| ▸ | EGFR known ✓ | P00533 | 1/20 | 0.43 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
| ▸ | TGM2 | P21980 | 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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL8645980 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| Acrylic Acid SCHEMBL859634 | 0.91 | LMNA (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| Bicarbonate SCHEMBL8361455 | 0.89 | ALDH1A1 (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| SCHEMBL26705 | 0.89 | — | — | |
| SCHEMBL35506 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| SCHEMBL3468962 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| SCHEMBL19457855 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| Hydrochloric Acid SCHEMBL29176180 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| Fluoride SCHEMBL21409814 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR | |
| Ammonia Solution, Strong SCHEMBL1036558 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19EGFR |
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-0861064-A1 | HAIR STYLING COMPOSITIONS CONTAINING NON-SILICONE AND SILICONE GRAFTED POLYMERS AND LOW LEVEL OF A VOLATILE HYDROCARBON SOLVENT | THE PROCTER & GAMBLE COMPANY (US) | 1998-09-02 | — | — | EP | disclosed |
| WO-1997015275-A1 | HAIR STYLING COMPOSITIONS CONTAINING NON-SILICONE AND SILICONE GRAFTED POLYMERS AND LOW LEVEL OF A VOLATILE HYDROCARBON SOLVENT | THE PROCTER & GAMBLE COMPANY (US) | 1997-05-01 | — | — | WO | disclosed |