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 | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.61 |
| ▸ | ADRB2 known ✓ | P07550 | 6/20 | 0.48 |
| ▸ | ADRB1 known ✓ | P08588 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | ADRB3 | P13945 | 6/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
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 SCHEMBL11079526 | 1.00 | MEN1 (0.61) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| SCHEMBL11072987 | 0.95 | MEN1 (0.67) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| Fumaric Acid SCHEMBL11075563 | 0.88 | ALDH1A1 (0.65) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| Fumaric Acid SCHEMBL11075555 | 0.88 | ALDH1A1 (0.65) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| SCHEMBL11078899 | 0.86 | MEN1 (0.70) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| SCHEMBL11079532 | 0.85 | MEN1 (0.48) | MEN1KMT2AALDH1A1 | |
| SCHEMBL11076646 | 0.83 | ALDH1A1 (0.71) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| Fumaric Acid SCHEMBL11075556 | 0.75 | ALDH1A1 (0.55) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| SCHEMBL11077151 | 0.74 | ALDH1A1 (0.78) | MEN1KMT2AALDH1A1ADRB3ADRB2 | |
| SCHEMBL11071832 | 0.74 | ADRB2 (0.57) | MEN1KMT2AALDH1A1ADRB3ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4450115-A | ADRENERGIC BLOCKING AGENTS; HYPOTENSIVE AND CARDIOTONIC AGENTS | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1984-05-22 | — | — | US | disclosed |
| US-4381398-A | Amino-alcohol derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1983-04-26 | — | — | US | disclosed |