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 | 0.40 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | TPH1 | P17752 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 SCHEMBL6139704 | 1.00 | LMNA (0.43) | LMNAKCNQ2SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL9424268 | 0.91 | LMNA (0.42) | LMNAKCNQ2SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL9424265 | 0.91 | LMNA (0.42) | LMNAKCNQ2SMN1; SMN2ALDH1A1CYP1A2 | |
| Methylamine SCHEMBL27301998 | 0.90 | LMNA (0.41) | LMNAKCNQ2SMN1; SMN2ALDH1A1CYP1A2 | |
| Fumaric Acid SCHEMBL2908209 | 0.81 | POLB (0.40) | KCNQ2SMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| Fumaric Acid SCHEMBL4968361 | 0.81 | POLB (0.40) | KCNQ2SMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| Fumaric Acid SCHEMBL2908206 | 0.81 | POLB (0.40) | KCNQ2SMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9424453 | 0.80 | SMN1; SMN2 (0.46) | LMNASMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9424451 | 0.80 | SMN1; SMN2 (0.46) | LMNASMN1; SMN2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9060495 | 0.79 | SMN1; SMN2 (0.43) | LMNAKCNQ2SMN1; SMN2ALDH1A1CYP1A2 |
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-1492557-A2 | XCRF POLYNUCLEOTIDES AND POLYPEPTIDES AND USES THEREOF | Serono Genetics Institute S.A. (FR) | 2005-01-05 | — | — | EP | disclosed |
| WO-2003082915-A2 | XCRF POLYNUCLEOTIDES AND POLYPEPTIDES AND USES THEREOF | GENSET SA (FR) | 2003-10-09 | — | — | WO | disclosed |