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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 4/20 | 0.59 |
| ▸ | GABRD | O14764 | 4/20 | 0.59 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.59 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.59 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.59 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.59 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.59 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.59 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.59 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.59 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.59 |
| ▸ | GABRE | P78334 | 4/20 | 0.59 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.59 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.59 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.59 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.59 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
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 SCHEMBL21145282 | 0.88 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Fumaric Acid SCHEMBL21145284 | 0.88 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Maleic Acid SCHEMBL8957408 | 0.88 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Maleic Acid SCHEMBL3118041 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Fumaric Acid SCHEMBL1835364 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Fumaric Acid SCHEMBL1835366 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Maleic Acid SCHEMBL29040732 | 0.83 | GABRP (0.54) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Fumaric Acid SCHEMBL31016717 | 0.82 | GABRP (0.59) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Fumaric Acid SCHEMBL28768987 | 0.82 | GABRP (0.59) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Valine SCHEMBL21465830 | 0.81 | SLC7A5 (0.75) | GABRPGABRDGABRA1GABRB1GABRG2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105636965-B | The ring type compound of sulfur-bearing two | 安斯泰来制药株式会社 | 2017-11-24 | — | — | CN | disclosed |
| CN-105636965-A | Sulfur-containing bicyclic compound | ASTELLAS PHARMA INC | 2016-06-01 | — | — | CN | disclosed |