Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.53 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | TNF | P01375 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.53 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
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 SCHEMBL10415402 | 1.00 | ACHE (0.55) | ACHEMEN1KMT2ATNFRAB9A | |
| Fumaric Acid SCHEMBL10414739 | 0.85 | MAPT (0.55) | ACHELMNAMAPT | |
| Fumaric Acid SCHEMBL10414741 | 0.85 | MAPT (0.55) | ACHELMNAMAPT | |
| SCHEMBL7540594 | 0.83 | ACHE (0.76) | ACHE | |
| Fumaric Acid SCHEMBL10415374 | 0.83 | GAA (0.54) | ACHEMEN1KMT2A | |
| Fumaric Acid SCHEMBL10415651 | 0.83 | ACHE (0.52) | ACHEMEN1KMT2ALMNAMAPT | |
| Fumaric Acid SCHEMBL10415652 | 0.83 | ACHE (0.52) | ACHEMEN1KMT2ALMNAMAPT | |
| Fumaric Acid SCHEMBL10415373 | 0.83 | GAA (0.54) | ACHEMEN1KMT2A | |
| Fumaric Acid SCHEMBL10416137 | 0.82 | ACHE (0.57) | ACHEMEN1KMT2ARAB9ALMNA | |
| Fumaric Acid SCHEMBL10416138 | 0.82 | ACHE (0.57) | ACHEMEN1KMT2ARAB9ALMNA |
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-4945096-A | Treatment of a depressive state with 2-[(4-piperidyl)methyl]-1,2,3,4-tetrahydroisoquinoline derivates | SYNTHELABO (FR) | 1990-07-31 | — | — | US | disclosed |
| US-4885302-A | 2-((4-Piperidyl)methyl)-1,2,3,4-tetrahydroisoquinoline derivatives, their preparation and their application in therapy | SYNTHELABO, 58, RUE DE LA GLACIERE - 75013 PARIS | 1989-12-05 | — | — | US | disclosed |