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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 2/20 | 0.50 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.50 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.43 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.43 |
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.43 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.43 |
| ▸ | JAK2 known ✓ | O60674 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7326408 | 0.94 | ADRA1A (0.56) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| SCHEMBL7328293 | 0.94 | ADRA1A (0.56) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| SCHEMBL7328765 | 0.94 | ADRA1A (0.56) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL7324783 | 0.93 | ADRA1D (0.55) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL7326075 | 0.93 | ADRA1D (0.55) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL7331899 | 0.93 | ADRA1D (0.55) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| Fumaric Acid SCHEMBL7330519 | 0.92 | SMN1; SMN2 (0.49) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E | |
| Fumaric Acid SCHEMBL7331898 | 0.91 | SMN1; SMN2 (0.48) | SMN1; SMN2LMNAHTR3AKMT2AMEN1 | |
| Fumaric Acid SCHEMBL7325589 | 0.90 | GAA (0.55) | ADRA1AADRA1DSMN1; SMN2KDM4EHTR3A | |
| Fumaric Acid SCHEMBL7335428 | 0.88 | KMT2A (0.43) | ADRA1AADRA1DSMN1; SMN2LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0376624-B1 | 4,5,6,7-Tetrahydrobenzimidazole derivatives and their preparation | YAMANOUCHI PHARMA CO LTD (JP) | 1994-09-14 | — | — | EP | disclosed |