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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.59 |
| ▸ | TBXAS1 | P24557 | 14/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 4/20 | 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 SCHEMBL10945469 | 1.00 | TBXAS1 (0.65) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL10657236 | 0.93 | TBXAS1 (0.74) | TBXAS1CYP19A1 | |
| Fumaric Acid SCHEMBL10946454 | 0.88 | TBXAS1 (0.59) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| Fumaric Acid SCHEMBL10946475 | 0.88 | TBXAS1 (0.59) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11354168 | 0.81 | TBXAS1 (0.74) | TBXAS1CYP19A1 | |
| SCHEMBL10851510 | 0.81 | TBXAS1 (0.67) | TBXAS1LMNACYP19A1 | |
| SCHEMBL10948037 | 0.80 | TBXAS1 (0.61) | TBXAS1CYP19A1 | |
| SCHEMBL10852178 | 0.80 | TBXAS1 (1.00) | TBXAS1CYP19A1 | |
| SCHEMBL10748096 | 0.79 | TBXAS1 (1.00) | TBXAS1LMNAMEN1KMT2A | |
| SCHEMBL29239321 | 0.79 | TBXAS1 (0.70) | TBXAS1CYP1A2USP2LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4555516-A | FOR TREATMENT OF CARDIOVASCULAR DISORDERS | PFIZER INC. (US) | 1985-11-26 | — | — | US | disclosed |
| US-4448781-A | CARDIOVASCULAR DISORDERS | PFIZER INC. (US) | 1984-05-15 | — | — | US | disclosed |