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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 2/20 | 0.45 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PAK4 | O96013 | 5/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | C5 | P01031 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL905771 | 0.89 | HTR2A (0.55) | HTR2APAK4SIRT1DYRK1AGSK3B | |
| Fumaric Acid SCHEMBL8151973 | 0.86 | NPSR1 (0.46) | BLMNPSR1HTR2ASIRT1DYRK1A | |
| Fumaric Acid SCHEMBL8146172 | 0.84 | HTR1A (0.47) | BLMNPSR1HTR2AMEN1MAPT | |
| Fumaric Acid SCHEMBL8146164 | 0.84 | HTR1A (0.47) | BLMNPSR1HTR2AMEN1MAPT | |
| Fumaric Acid SCHEMBL8153286 | 0.78 | BLM (0.43) | BLMNPSR1HTR2A | |
| SCHEMBL17229330 | 0.78 | HTR2A (0.43) | HTR2ASIRT1DYRK1AGSK3BJAK2 | |
| Fumaric Acid SCHEMBL8150968 | 0.77 | BLM (0.40) | BLMNPSR1SIRT1 | |
| Fumaric Acid SCHEMBL8138713 | 0.75 | MAPK8 (0.40) | BLMNPSR1HTR2A | |
| Fumaric Acid SCHEMBL8138709 | 0.75 | MAPK8 (0.40) | BLMNPSR1HTR2A | |
| SCHEMBL5987890 | 0.75 | HTR2A (0.55) | BLMNPSR1HTR2ADYRK1AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000012482-A2 | INDAZOLE DERIVATIVES WITH 5-HT2 RECEPTOR ACTIVITY | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | disclosed |