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 | |
|---|---|---|---|---|
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.42 |
| ▸ | HTR2A known ✓ | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C known ✓ | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 known ✓ | P35367 | 1/20 | 0.39 |
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.39 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | POLR1A | O95602 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8300350 | 0.92 | KEAP1 (0.54) | KEAP1PDPK1BCHEKDM4EMAPT | |
| Fumaric Acid SCHEMBL8428574 | 0.79 | HDAC1 (0.56) | KEAP1KDM4EMAPTKMT2ARAB9A | |
| SCHEMBL30088294 | 0.75 | KEAP1 (0.64) | KEAP1PDPK1BCHEKDM4EMAPT | |
| SCHEMBL28600150 | 0.75 | KEAP1 (0.64) | KEAP1PDPK1BCHEKDM4EMAPT | |
| Fumaric Acid SCHEMBL5238696 | 0.74 | PDPK1 (0.81) | KEAP1PDPK1KDM4EMAPTKMT2A | |
| Fumaric Acid SCHEMBL5238668 | 0.74 | PDPK1 (0.81) | KEAP1PDPK1KDM4EMAPTKMT2A | |
| SCHEMBL5486616 | 0.74 | KEAP1 (0.58) | KEAP1PDPK1BCHEKDM4EMAPT | |
| SCHEMBL8291239 | 0.72 | HDAC1 (0.59) | KEAP1PDPK1BCHEKDM4EMAPT | |
| Fumaric Acid SCHEMBL9434866 | 0.72 | PDPK1 (0.47) | KEAP1PDPK1HTR7HTR2AHTR2C | |
| SCHEMBL18937409 | 0.71 | KEAP1 (0.57) | KEAP1PDPK1BCHEKDM4EMAPT |
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-0599240-B1 | Indole-7-carboxamide derivatives as analgesics | HOECHST MARION ROUSSEL INC (US) | 1999-03-31 | — | — | EP | disclosed |
| EP-0599240-A1 | Indole-7-carboxamide derivatives as analgesics | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-06-01 | — | — | EP | disclosed |