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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 11/20 | 0.48 |
| ▸ | HTR2C known ✓ | P28335 | 11/20 | 0.48 |
| ▸ | HTR2B known ✓ | P41595 | 11/20 | 0.48 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | GFER | P55789 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | INMT | O95050 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
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 SCHEMBL7543324 | 1.00 | LMNA (0.55) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4830648 | 1.00 | LMNA (0.55) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4830658 | 1.00 | LMNA (0.55) | LMNAPMP22NPSR1GFERHTR2A | |
| SCHEMBL4830620 | 0.90 | HTR2A (0.57) | LMNAPMP22NPSR1GFERHTR2A | |
| SCHEMBL7501270 | 0.90 | HTR2A (0.57) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4830650 | 0.82 | LMNA (0.37) | LMNAPMP22NPSR1GFERCYP3A4 | |
| Fumaric Acid SCHEMBL4824850 | 0.78 | HTR2A (0.80) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4824843 | 0.78 | HTR2A (0.80) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4822638 | 0.77 | HTR2C (0.81) | LMNAPMP22NPSR1GFERHTR2A | |
| Fumaric Acid SCHEMBL4822644 | 0.77 | HTR2C (0.81) | LMNAPMP22NPSR1GFERHTR2A |
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-1202964-A1 | CONDENSED INDOLINE DERIVATIVES AND THEIR USE AS 5HT, IN PARTICULAR 5HT2C, RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2002-05-08 | — | — | EP | disclosed |
| WO-2001012602-A1 | CONDENSED INDOLINE DERIVATIVES AND THEIR USE AS 5HT, IN PARTICULAR 5HT2C, RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2001-02-22 | — | — | WO | disclosed |