Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol
The experimentally established mechanism targets of Maleic 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 | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 8/20 | 0.43 |
| ▸ | SLC6A2 known ✓ | P23975 | 6/20 | 0.43 |
| ▸ | SLC6A3 known ✓ | Q01959 | 3/20 | 0.40 |
| ▸ | HTR2A known ✓ | P28223 | 3/20 | 0.39 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.39 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.39 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.39 |
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.39 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.41 |
| ▸ | SGK1 | O00141 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.37 |
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 SCHEMBL3156692 | 1.00 | SLC6A4 (0.43) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Fumaric Acid SCHEMBL3156688 | 1.00 | SLC6A4 (0.43) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Fumaric Acid SCHEMBL3154243 | 0.94 | SLC6A4 (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Fumaric Acid SCHEMBL3154237 | 0.94 | SLC6A4 (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Maleic Acid SCHEMBL3154226 | 0.94 | SLC6A4 (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Maleic Acid SCHEMBL3161156 | 0.94 | SCN9A (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Fumaric Acid SCHEMBL3161163 | 0.94 | SCN9A (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| Fumaric Acid SCHEMBL3161160 | 0.94 | SCN9A (0.46) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| SCHEMBL3154145 | 0.93 | SLC6A4 (0.44) | SLC6A4SLC6A2SCN9ASCN5ASCN2A | |
| SCHEMBL3154155 | 0.93 | SLC6A4 (0.44) | SLC6A4SLC6A2SCN9ASCN5ASCN2A |
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-1828182-B1 | THERAPEUTIC PYRAZOLO[3,4-B]PYRIDINES AND INDAZOLES | WARNER LAMBERT CO (US) | 2010-03-10 | — | — | EP | disclosed |