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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A known ✓ | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 known ✓ | O00255 | 4/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.56 |
| ▸ | BCHE | P06276 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.51 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
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 SCHEMBL9416593 | 1.00 | ACHE (0.56) | ACHEBCHEALDH1A1HSD17B2KMT2A | |
| SCHEMBL1134084 | 0.86 | KMT2A (0.61) | ACHEBCHEALDH1A1HSD17B2KMT2A | |
| SCHEMBL30093216 | 0.82 | CALM1 (0.60) | ACHEBCHEALDH1A1KMT2AMEN1 | |
| Maleic Acid SCHEMBL9416530 | 0.81 | MEN1 (0.74) | BCHEALDH1A1KMT2AMEN1KDM4E | |
| Fumaric Acid SCHEMBL9416535 | 0.81 | MEN1 (0.74) | BCHEALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL19002584 | 0.81 | HSD17B2 (0.60) | ACHEBCHEHSD17B2KMT2AMEN1 | |
| SCHEMBL6417242 | 0.80 | HSD17B2 (0.63) | ACHEBCHEHSD17B2KMT2AMEN1 | |
| SCHEMBL9416597 | 0.80 | ACHE (0.59) | ACHEBCHEALDH1A1HSD17B2KMT2A | |
| Dibemethine SCHEMBL9416520 | 0.79 | NPC1 (0.63) | ACHEBCHEALDH1A1KMT2AMEN1 | |
| Dibemethine SCHEMBL9416516 | 0.79 | NPC1 (0.63) | ACHEBCHEALDH1A1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0613879-A1 | PHELLODENDRINE ANALOGS AND ALLERGY TYPE IV SUPPRESSOR CONTAINING THE SAME AS ACTIVE INGREDIENT | TSUMURA & CO. (JP) | 1994-09-07 | — | — | EP | disclosed |