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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.57 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | HTR1D | P28221 | 1/20 | 0.57 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 SCHEMBL8799091 | 1.00 | HTR1A (0.57) | HTR1AHTR1DHTR2BCCR8CCR5 | |
| SCHEMBL8799021 | 0.96 | HTR1A (0.61) | HTR1AHTR1DHTR2BCCR8CCR5 | |
| SCHEMBL8796977 | 0.96 | HTR1A (0.61) | HTR1AHTR1DHTR2BCCR8CCR5 | |
| Hydrochloric Acid SCHEMBL8798496 | 0.95 | HTR1A (0.60) | HTR1AHTR1DHTR2BCCR8CCR5 | |
| SCHEMBL9001256 | 0.81 | HTR1A (0.68) | HTR1AHTR1DHTR2BCCR8CCR5 | |
| SCHEMBL8796812 | 0.77 | HTR1A (0.60) | HTR1AHTR1DHTR2BCCR8ALDH1A1 | |
| Iodide SCHEMBL8798221 | 0.76 | HTR1A (0.59) | HTR1AHTR1DHTR2BCCR8ALDH1A1 | |
| SCHEMBL8798584 | 0.74 | HTR1A (0.56) | HTR1AHTR1DHTR2BCCR8ALDH1A1 | |
| SCHEMBL8798591 | 0.74 | HTR1A (0.56) | HTR1AHTR1DHTR2BCCR8ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8958128 | 0.73 | HTR1A (0.55) | HTR1AHTR1DHTR2BCCR8ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0793663-A1 | (THIOPHEN-2-YL)-PIPERIDIN OR TETRAHYDROPYRIDIN CARBOXAMIDES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-09-10 | — | — | EP | claimed |
| US-5525600-A | COMPOUND USEFUL AS ANTIPSYCHOTIC, ANTIDEPRESSANT AND ANXIBLYTIC AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-06-11 | — | — | US | claimed |
| WO-1996016961-A1 | (THIOPHEN-2-YL)-PIPERIDIN OR TETRAHYDROPYRIDIN CARBOXAMIDES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-06-06 | — | — | WO | claimed |
| US-5525600-A | COMPOUND USEFUL AS ANTIPSYCHOTIC, ANTIDEPRESSANT AND ANXIBLYTIC AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-06-11 | — | — | US | disclosed |