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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 3/20 | 0.41 |
| ▸ | HTR1A known ✓ | P08908 | 2/20 | 0.40 |
| ▸ | HTR2A known ✓ | P28223 | 2/20 | 0.40 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8649737 | 0.93 | NPC1 (0.49) | NPC1RAB9ADRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8650993 | 0.92 | NPC1 (0.42) | NPC1RAB9ADRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8667106 | 0.91 | NPC1 (0.44) | NPC1RAB9ADRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8647009 | 0.91 | NPC1 (0.43) | NPC1RAB9ADRD2DRD4DRD5 | |
| SCHEMBL8646575 | 0.86 | NPC1 (0.47) | NPC1RAB9ADRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8648545 | 0.85 | FBP1 (0.38) | NPC1RAB9ACA9CA12FBP1 | |
| Fumaric Acid SCHEMBL8644275 | 0.85 | UTS2R (0.46) | NPC1RAB9ADRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8645724 | 0.84 | RAB9A (0.36) | NPC1RAB9ACA9CA12FBP1 | |
| Fumaric Acid SCHEMBL8649719 | 0.84 | HTR1A (0.44) | NPC1RAB9ADRD2HTR1AHTR2A | |
| SCHEMBL8644510 | 0.84 | DRD2 (0.45) | NPC1RAB9ADRD2DRD4DRD5 |
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 |
|---|---|---|---|---|---|---|---|
| US-5773437-A | UROGENITAL DISORDERS SUCH AS DYSURIA | NIPPON CHEMIPHAR CO., LTD. (JP) | 1998-06-30 | — | — | US | disclosed |