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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | HTT | P42858 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | NMT1 | P30419 | 1/20 | 0.52 |
| ▸ | FOS | P01100 | 1/20 | 0.47 |
| ▸ | JUN | P05412 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL20560077 | 0.94 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTLMNAHPGD | |
| SCHEMBL3633623 | 0.90 | FOS (0.56) | ALDH1A1HTTMAPTLMNAHPGD | |
| SCHEMBL3633625 | 0.90 | FOS (0.56) | ALDH1A1HTTMAPTLMNAHPGD | |
| Acrylic Acid SCHEMBL80864 | 0.89 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTLMNAHPGD | |
| Bicarbonate SCHEMBL3208132 | 0.89 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTLMNAHPGD | |
| Acetic Acid SCHEMBL28854711 | 0.87 | ALDH1A1 (0.50) | ALDH1A1HTTMAPTLMNAHPGD | |
| P-Xylene SCHEMBL6232601 | 0.84 | ALDH1A1 (0.74) | ALDH1A1HTTMAPTLMNAHPGD | |
| Benzene SCHEMBL28408287 | 0.82 | ALDH1A1 (0.61) | ALDH1A1MAPTLMNAHPGDNPSR1 | |
| SCHEMBL679555 | 0.82 | ALDH1A1 (0.69) | ALDH1A1MAPTNPSR1CYP3A4KMT2A | |
| SCHEMBL14911 | 0.82 | — | — |
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-5631309-A | MIXTURE OF DYE AND POLYMER WHICH CAN UNDERGO DECARBOXYLATION; WATERPROOFING; NONSCORCHING AND NONSTICKING | KAO CORPORATION (JP) | 1997-05-20 | — | — | US | disclosed |