Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol
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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 4/20 | 0.49 |
| ▸ | HTR2A known ✓ | P28223 | 3/20 | 0.47 |
| ▸ | HTR2C known ✓ | P28335 | 3/20 | 0.47 |
| ▸ | HTR2B known ✓ | P41595 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | BCHE | P06276 | 3/20 | 0.47 |
| ▸ | ACHE | P22303 | 3/20 | 0.47 |
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL10795162 | 1.00 | DRD2 (0.49) | DRD2DRD4DRD3SIGMAR1BCHE | |
| Maleic Acid SCHEMBL10799180 | 0.93 | DRD2 (0.54) | DRD2DRD4DRD3SIGMAR1BCHE | |
| Fumaric Acid SCHEMBL10799186 | 0.93 | DRD2 (0.54) | DRD2DRD4DRD3SIGMAR1BCHE | |
| SCHEMBL10797797 | 0.90 | ACHE (0.54) | DRD2DRD4DRD3SIGMAR1BCHE | |
| Maleic Acid SCHEMBL10800330 | 0.89 | SIGMAR1 (0.48) | DRD2SIGMAR1HTR2AHTR2CHTR2B | |
| Fumaric Acid SCHEMBL10800336 | 0.89 | SIGMAR1 (0.48) | DRD2SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL10795431 | 0.82 | SIGMAR1 (0.60) | DRD2DRD4DRD3SIGMAR1BCHE | |
| SCHEMBL10797896 | 0.82 | CARM1 (0.52) | DRD2DRD4DRD3SIGMAR1BCHE | |
| Oxalic Acid SCHEMBL10799899 | 0.81 | KMT2A (0.57) | DRD2DRD4BCHEACHEBACE1 | |
| SCHEMBL10799175 | 0.79 | ACHE (0.55) | BCHEACHEBACE1SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4642348-A | ANTIARRHYTHMIA AGENTS | A. H. ROBINS COMPANY, INCORPORATED (US) | 1987-02-10 | — | — | US | disclosed |
| US-4593102-A | N-[(amino)alkyl]-1-pyrrolidine, 1-piperidine and 1-homopiperidinecarboxamides (and thiocarboxamides) with sulfur linked substitution in the 2, 3 or 4-position | A. H. ROBINS COMPANY, INC. (US) | 1986-06-03 | — | — | US | disclosed |
| EP-0160436-A2 | N-[(Amino)Alkyl]-1-pyrrolidine, 1-piperidine and 1-homopiperidinecarboxamides (and thiocarboxamides) with sulphur linked substitution in the 2, 3 or 4-position | A.H. ROBINS COMPANY, INCORPORATED (US) | 1985-11-06 | — | — | EP | disclosed |