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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 2/20 | 0.72 |
| ▸ | DRD2 known ✓ | P14416 | 2/20 | 0.50 |
| ▸ | HTR1D | P28221 | 7/20 | 0.53 |
| ▸ | HTR1B | P28222 | 7/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL7513537 | 1.00 | HTR1A (0.72) | HTR1AHTR1DHTR1BDRD2ALDH1A1 | |
| SCHEMBL8983347 | 0.94 | HTR1A (0.81) | HTR1AHTR1DHTR1BDRD2 | |
| SCHEMBL6765275 | 0.94 | HTR1A (0.81) | HTR1AHTR1DHTR1BDRD2 | |
| SCHEMBL6364891 | 0.94 | HTR1A (0.81) | HTR1AHTR1DHTR1BDRD2 | |
| Acetic Acid SCHEMBL7513634 | 0.93 | HTR1A (0.80) | HTR1AHTR1DHTR1BDRD2 | |
| Oxalic Acid SCHEMBL7515265 | 0.93 | HTR1A (0.77) | HTR1AHTR1DHTR1BDRD2 | |
| Bromide SCHEMBL7511914 | 0.93 | HTR1A (0.80) | HTR1AHTR1DHTR1BDRD2 | |
| Succinic Acid SCHEMBL7518514 | 0.91 | HTR1A (0.74) | HTR1AHTR1DHTR1BDRD2 | |
| Sulfuric Acid SCHEMBL10347223 | 0.90 | HTR1A (0.75) | HTR1AHTR1DHTR1BDRD2 | |
| SCHEMBL7514239 | 0.90 | HTR1A (0.74) | HTR1AHTR1DHTR1BDRD2 |
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-1166783-A2 | Tetrahydrobenz[CD]indole-6-carboxamides for treating sexual dysfunction | ELI LILLY AND COMPANY (US) | 2002-01-02 | — | — | EP | disclosed |
| EP-0633023-A2 | Preventing emesis and treating sexual dysfunction using tetrahydrobenz CD indole-6-carboxamides | ELI LILLY AND COMPANY (US) | 1995-01-11 | — | — | EP | disclosed |