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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 SCHEMBL3663487 | 1.00 | TSHR (0.35) | TSHRTP53EGLN1EGLN3MAPT | |
| Hydrochloric Acid SCHEMBL5399209 | 0.79 | — | — | |
| Fumaric Acid SCHEMBL27312490 | 0.61 | TSHR (0.60) | TSHRTP53EGLN1EGLN3MAPT | |
| Maleic Acid SCHEMBL27512927 | 0.61 | TSHR (0.60) | TSHRTP53EGLN1EGLN3MAPT | |
| Fumaric Acid SCHEMBL14717098 | 0.59 | TSHR (0.82) | TSHRTP53EGLN1EGLN3MAPT | |
| Maleic Acid SCHEMBL29014432 | 0.59 | — | — | |
| Maleic Acid SCHEMBL29929045 | 0.59 | TSHR (0.82) | TSHRTP53EGLN1EGLN3MAPT | |
| Maleic Acid SCHEMBL28479275 | 0.59 | TSHR (0.82) | TSHRTP53EGLN1EGLN3MAPT | |
| Maleic Acid SCHEMBL30753765 | 0.59 | TSHR (0.82) | TSHRTP53EGLN1EGLN3MAPT | |
| Maleic Acid SCHEMBL27583410 | 0.59 | TSHR (0.82) | TSHRTP53EGLN1EGLN3MAPT |
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-2231648-A1 | NEW SALTS AND CRYSTAL FORMS | BIAL - Portela & Ca., S.A. (PT) | 2010-09-29 | — | — | EP | claimed |
| WO-2009072915-A1 | NEW SALTS AND CRYSTAL FORMS | BIAL - PORTELA & CA., S.A. (PT) | 2009-06-11 | — | — | WO | claimed |