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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 known ✓ | P35367 | 1/20 | 0.58 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.54 |
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.56 |
| ▸ | CYP2J2 | P51589 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 SCHEMBL10460907 | 1.00 | HRH1 (0.58) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| Fumaric Acid SCHEMBL10461769 | 0.97 | HRH1 (0.59) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| Fumaric Acid SCHEMBL10461767 | 0.97 | HRH1 (0.59) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| SCHEMBL10462896 | 0.94 | HRH1 (0.61) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| SCHEMBL10461574 | 0.92 | HRH1 (0.62) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| Fumaric Acid SCHEMBL10461081 | 0.91 | KCNH2 (0.62) | PAX8KCNH2MEN1KMT2A | |
| Fumaric Acid SCHEMBL10461083 | 0.91 | KCNH2 (0.62) | PAX8KCNH2MEN1KMT2A | |
| Fumaric Acid SCHEMBL10461718 | 0.89 | KCNH2 (0.58) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| Fumaric Acid SCHEMBL10461719 | 0.89 | KCNH2 (0.58) | HRH1PAX8KCNH2MEN1CYP2J2 | |
| Fumaric Acid SCHEMBL10460991 | 0.88 | KCNH2 (0.60) | PAX8KCNH2MEN1CYP2J2KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4950674-A | Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1990-08-21 | — | — | US | disclosed |