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 | 3/20 | 0.55 |
| ▸ | KMT2A known ✓ | Q03164 | 3/20 | 0.55 |
| ▸ | KARS1 | Q15046 | 4/20 | 0.56 |
| ▸ | RXRA | P19793 | 1/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.56 |
| ▸ | CDK2 | P24941 | 1/20 | 0.56 |
| ▸ | RXRB | P28702 | 1/20 | 0.56 |
| ▸ | RXRG | P48443 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.55 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.55 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.55 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
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 SCHEMBL2727847 | 1.00 | KARS1 (0.56) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL2728615 | 1.00 | KARS1 (0.56) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL15389008 | 0.97 | KARS1 (0.57) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL2728216 | 0.97 | KARS1 (0.57) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL2728217 | 0.97 | KARS1 (0.57) | KARS1RXRACCNE1CDK2RXRB | |
| SCHEMBL2727992 | 0.90 | CYP3A4 (0.63) | KARS1RXRACCNE1CDK2RXRB | |
| SCHEMBL2727991 | 0.90 | CYP3A4 (0.63) | KARS1RXRACCNE1CDK2RXRB | |
| SCHEMBL20856766 | 0.86 | KARS1 (0.69) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL15389438 | 0.84 | KARS1 (0.53) | KARS1RXRACCNE1CDK2RXRB | |
| Fumaric Acid SCHEMBL2727937 | 0.84 | KARS1 (0.53) | KARS1RXRACCNE1CDK2RXRB |
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-2632892-A1 | DITERPENOID DERIVATIVES ENDOWED OF BIOLOGICAL PROPERTIES | SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012055894-A1 | DITERPENOID DERIVATIVES ENDOWED OF BIOLOGICAL PROPERTIES | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2012-05-03 | — | — | WO | disclosed |